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Shanghai Chemrole Co., Ltd.

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Profile: Shanghai Chemrole Co., Ltd. specializes in providing active pharmaceutical ingredients and fine chemicals. Our active pharmaceutical ingredients include travoprost, latanoprost, isopropyl unoprostone, bimatoprost, alprostadil, lubiprostone, etiproston, dinoprostone, cloprostenol and tiaprost. We offer a wide range of fine chemicals including 2,4-dichloropyrimidine, 4,6- dichloropyrimidine, 4,6-dichloro-2-methylpyrimidine, 2-amino-4,6-dimethylpyrimidine, 2-amino-4-chloro-6-methoxypyrimidine, 3-nitrobenzotrifluoride, 3-aminotrifluorotoluene and 2,3-difluoro-5-chloro pyridine.

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• Acetoguanamine
IUPAC Name: 6-methyl-1,3,5-triazine-2,4-diamine | CAS Registry Number: 542-02-9
Synonyms: 2,4-Diamino-6-methyl-1,3,5-triazine, NSC 257, ENT 50715, 407801_ALDRICH, NSC257, s-Triazine, 2,4-diamino-6-methyl-, EINECS 208-796-3, 1,3,5-Triazine-2,4-diamine, 6-methyl-, 2-Methyl-4,6-diamino-1,3,5-triazine, 6-Methyl-1,3,5-triazine-2,4-diamine, ZINC01555389, 2,4-DIAMINO-6-METHYL-S-TRIAZINE, AI3-50715, 6-Methyl-1,3,5-triazine-2,4-diyldiamine, LS-168045, s-Triazine, 2,4-diamino-6-methyl- (8CI), InChI=1/C4H7N5/c1-2-7-3(5)9-4(6)8-2/h1H3,(H4,5,6,7,8,9

Molecular Formula: C4H7N5Molecular Weight: 125.131880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: NJYZCEFQAIUHSD-UHFFFAOYSA-N

• alpha-Tetralone
IUPAC Name: 3,4-dihydro-2H-naphthalen-1-one | CAS Registry Number: 529-34-0
Synonyms: .alpha.-Tetralone, 1-Oxotetralin, 1-TETRALONE, tetralin-1-one, 1(2H)-Naphthalenone, 3,4-dihydro-, 3,4-Dihydro-1(2H)-naphthalenone, T19003_ALDRICH, WLN: L66 BVT&J, 3,4-Dihydro-2H-naphthalen-1-one, HSDB 5678, 3,4-Dihydronaphthalen-1-one, 1,2,3,4-Tetrahydronaphthalen-1-one, 3,4-dihydronaphthalen-1(2H)-one, 1,2,3,4-Tetrahydronaphthalone, NSC 5171, 87661_FLUKA, EINECS 208-460-6, NSC5171, BB_SC-1603, BRN 0607374

Molecular Formula: C10H10OMolecular Weight: 146.185800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XHLHPRDBBAGVEG-UHFFFAOYSA-N

• Benzoguanamine
IUPAC Name: 6-phenyl-1,3,5-triazine-2,4-diamine | CAS Registry Number: 91-76-9
Synonyms: Benzoguanimine, Benzoguanamine (VAN), USAF RH-5, s-Triazine, 2,4-diamino-6-phenyl-, 2,4-Diamino-6-phenyl-s-triazine, 2-Phenyl-4,6-diamino-s-triazine, 4,6-Diamino-2-phenyl-s-triazine, D23408_ALDRICH, 6-Phenyl-1,3,5-triazine-2,4-diamine, HSDB 5275, MLS000079044, MLS002207438, 1,3,5-Triazine-2,4-diamine, 6-phenyl-, ENT 60118, CCRIS 9098, NSC 3267, STOCK1S-00285, EINECS 202-095-6, CID7064, NSC3267

Molecular Formula: C9H9N5Molecular Weight: 187.201260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GZVHEAJQGPRDLQ-UHFFFAOYSA-N

• Benzophenone imine
IUPAC Name: di(phenyl)methanimine | CAS Registry Number: 1013-88-3
Synonyms: Diphenylmethanimine, Oprea1_372891, Oprea1_617070, ARONIS000349, Benzenemethanimine, .alpha.-phenyl-, Benzenemethanimine, alpha-phenyl-, 293733_SIAL, ZINC01095290, ST5307507, TL8000092

Molecular Formula: C13H11NMolecular Weight: 181.233140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SXZIXHOMFPUIRK-UHFFFAOYSA-N

• Benzyl Chloride
IUPAC Name: chloromethylbenzene | CAS Registry Number: 100-44-7
Synonyms: BENZYL CHLORIDE, Tolyl chloride, Chloromethylbenzene, Benzylchloride, (Chloromethyl)benzene, Chlorophenylmethane, alpha-Chlorotoluene, Benzylchlorid, Benzene, (chloromethyl)-, Merrifield resin, Toluene, ar-chloro-, CHLOROTOLUENE, omega-Chlorotoluene, chloromethyl-benzene, Oxsol 10, Chlorure de benzyle, Benzene, chloromethyl-, .alpha.-Chlortoluol, Benzile(cloruro di), Benzylchlorid [German]

Molecular Formula: C7H7ClMolecular Weight: 126.583480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KCXMKQUNVWSEMD-UHFFFAOYSA-N

• Benzyl Triphenyl Phosphonium Chloride
IUPAC Name: benzyl(triphenyl)phosphanium chloride | CAS Registry Number: 1100-88-5
Synonyms: Benzyltriphenylphosphonium chloride, Triphenylbenzylphosphonium chloride, B32807_ALDRICH, EINECS 214-154-3, NSC 116712, Phosphonium, benzyltriphenyl-, chloride, benzyl-triphenyl-phosphonium chloride, NSC116712, Phosphonium, triphenyl(phenylmethyl)-, chloride, LS-106935, TL8000316, Phosphonium, benzyltriphenyl-, chloride (8CI)

Molecular Formula: C25H22ClPMolecular Weight: 388.868941 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: USFRYJRPHFMVBZ-UHFFFAOYSA-M

• Bis(4-amino-2,3-dichlorophenyl)methane
IUPAC Name: 4-[(4-amino-2,3-dichlorophenyl)methyl]-2,3-dichloroaniline | CAS Registry Number: 42240-73-3
Synonyms: CID148445, ZINC02556743, 4,4'-Methylenebis(2,3-dichloroaniline), Benzenamine, 4,4'-methylenebis(2,3-dichloro-, B1823, 4,4'-Diamino-2,2',3,3'-tetrachlorodiphenylmethane

Molecular Formula: C13H10Cl4N2Molecular Weight: 336.043900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PPUHQXZSLCCTAN-UHFFFAOYSA-N

• Bisphenol AF
IUPAC Name: 4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol | CAS Registry Number: 1478-61-1
Synonyms: Biphenol AF, Hexafluorobisphenol a, Hexafluorodiphenylolpropane, Hexafluoroacetone bisphenol A, TimTec1_001644, 4,4'-(Hexafluoroisopropylidene)diphenol, 257591_ALDRICH, EINECS 216-036-7, 2,2-Bis(4-hydroxyphenyl)perfluoropropane, NSC 152522, 2,2-Bis(4-hydroxyphenyl)hexafluoropropane, Hexafluoroisopropylidenebis(4-hydroxybenzene), NSC152522, SBB001375, STK396229, ZINC00043843, 2,2-Bis-(p-hydroxyphenyl)-hexafluoropropane, NCGC00164114-01, NCGC00164114-02, Phenol, 4,4'-(bis(trifluoromethyl)methylene)di-

Molecular Formula: C15H10F6O2Molecular Weight: 336.229119 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: ZFVMWEVVKGLCIJ-UHFFFAOYSA-N

• Butyrophenone
IUPAC Name: 1-phenylbutan-1-one | CAS Registry Number: 495-40-9
Synonyms: BUTYROPHENONE, n-Butyrophenone, Phenyl propyl ketone, 1-Butanone, 1-phenyl-, 1-Phenyl-1-butanone, Propyl phenyl ketone, 1-phenylbutan-1-one, Ambap7439, W504904_ALDRICH, 124338_ALDRICH, 20770_FLUKA, NSC8463, NSC 8463, EINECS 207-799-7, ZINC01586755, AI3-02062, InChI=1/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H

Molecular Formula: C10H12OMolecular Weight: 148.201680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FFSAXUULYPJSKH-UHFFFAOYSA-N

• Cyclopentylamine
IUPAC Name: cyclopentanamine | CAS Registry Number: 1003-03-8
Synonyms: Cyclopentanamine, Aminocyclopentane, C115002_ALDRICH, EINECS 213-697-3, NSC 32389, CB 1689, NSC32389, BRN 0635706, LS-58428, ST5213778, 4-12-00-00004 (Beilstein Handbook Reference), InChI=1/C5H11N/c6-5-3-1-2-4-5/h5H,1-4,6H, 1CB

Molecular Formula: C5H11NMolecular Weight: 85.147540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: NISGSNTVMOOSJQ-UHFFFAOYSA-N

• Decylamine
IUPAC Name: decan-1-amine | CAS Registry Number: 2016-57-1
Synonyms: 1-Decanamine, 1-Aminodecane, Monodecylamine, Aminodecane, N-DECYLAMINE, decan-1-amine, 1-Decylamine, 1-Decaneamine, Kemamine P 190D, DECANE,1-AMINO, D2404_ALDRICH, HSDB 7324, 30692_ALDRICH, 442540_SUPELCO, 30680_FLUKA, 30692_FLUKA, EINECS 217-957-7, CID8916, CHEBI:282189, BRN 1735220

Molecular Formula: C10H23NMolecular Weight: 157.296320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MHZGKXUYDGKKIU-UHFFFAOYSA-N

• Dibenzo-18-Crown-6
Synonyms: Dibenzocrown, Crown 18, DIBENZO-18-CROWN-6, Dibenzo-18-crown-6-ether, Crown-18, Dicyclohexano-18-crown-6, 158399_ALDRICH, 33531_FLUKA, EINECS 238-041-3, NSC 147771, CID26541, BRN 1162153, NSC147771, ZINC03861212, LS-61119, ST023790, TL8000928, C14289, AE-641/00796004, Dibenzo(b,k)(1,4,7,10,13,16)hexaoxacyclooctadecane

Molecular Formula: C20H24O6Molecular Weight: 360.400960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: YSSSPARMOAYJTE-UHFFFAOYSA-N

• Dichlorinated Sodium Isocyanurate
IUPAC Name: 1,3-dichloro-1,3,5-triazinane-2,4,6-trione | CAS Registry Number: 2893-78-9
Synonyms: Troclosene, Orced, chlorcyanurate, chlordesine, chlordezine, Neoaquasept, Dikonit, Presept, Dikon, Dichlorocyanuric acid, Dichloroisocyanurate, Hilite 60, Isocyanuric dichloride, Troclosene [INN], Caswell No. 327, Fi Clor 71, Dichloro-s-triazinetrione, DICHLOROISOCYANURIC ACID, Isocyanuric acid, dichloro-, C3HCl2N3O3

Molecular Formula: C3HCl2N3O3Molecular Weight: 197.964340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CEJLBZWIKQJOAT-UHFFFAOYSA-N

• Diethyl 2-Amino Malonate Hydrochloride
IUPAC Name: diethyl 2-aminopropanedioate hydrochloride | CAS Registry Number: 13433-00-6
Synonyms: Diethyl aminomalonate hydrochloride, D87589_ALDRICH, DIETHYLAMINO MALONATE HCl, NSC76074, EINECS 236-556-8, CID3084143, TL806211, ST5308255, Aminomalonic acid diethyl ester hydrochloride, 6829-40-9

Molecular Formula: C7H14ClNO4Molecular Weight: 211.643360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GLFVNTDRBTZJIY-UHFFFAOYSA-N

• Diethyl N,N-Bis-(2-Hydroxyethy)] Aminomethylphosphonate
IUPAC Name: 2-[diethoxyphosphorylmethyl(2-hydroxyethyl)amino]ethanol | CAS Registry Number: 2781-11-5
Synonyms: Fyrol 6, Adeka FC 450, HSDB 5896, EINECS 220-482-8, Diethyl (diethanolamino)methylphosphonate, FC 450, NSC 82342, CID17722, NSC82342, BRN 1958844, Diethyl bis(2-hydroxyethyl)aminomethylphosphonate, Diethyl N,N-bis(hydroxyethyl)aminomethylphosphonate, LS-106466, DIETHYL ((DIETHANOLAMINO)METHYL)PHOSPHONATE, Diethyl ((bis(2-hydroxyethyl)amino)methyl)phosphonate, O,O-Diethyl N,N-bis(2-hydroxyethyl)aminomethyl phosphonate, Diethyl (N,N-bis(2-hydroxyethyl)amino)methanephosphonate, Diethyl ((N,N-bis(2-hydroxyethyl)amino)methyl)phosphonate, O,O-Diethyl ((bis(2-hydroxyethyl)amino)methyl)phosphonate, diethyl {[bis(2-hydroxyethyl)amino]methyl}phosphonate

Molecular Formula: C9H22NO5PMolecular Weight: 255.248441 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: CCJKFLLIJCGHMO-UHFFFAOYSA-N

• Dimethoxy-Ethane
IUPAC Name: dimethoxymethane | CAS Registry Number: 109-87-5
Synonyms: Dimethoxymethane, Dimethyl formal, Anesthenyl, Formal, Methane, dimethoxy-, METHYLAL, 2,4-Dioxapentane, Bis(methoxy)methane, Metylal [Polish], Methylene dimethyl ether, Formaldehyde dimethyl acetal, Methoxymethyl methyl ether, bis(methyloxy)methane, Formaldehyde methyl ketal, Formaldehyde dimethylacetal, Methylene glycol dimethylether, HSDB 1820, 47649_FLUKA, 47676_FLUKA, 88789_FLUKA

Molecular Formula: C3H8O2Molecular Weight: 76.094420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NKDDWNXOKDWJAK-UHFFFAOYSA-N

• Dimethyl Mercaptal S-Oxide
IUPAC Name: methylsulfinylmethane | CAS Registry Number: 67-68-5
Synonyms: dimethyl sulfoxide, Methyl sulfoxide, DMSO, Demasorb, Dimexide, Domoso, Dimethyl sulphoxide, Dimethylsulfoxide, Infiltrina, Demsodrox, Somipront, Dromisol, Durasorb, Syntexan, Demavet, Dolicur, Deltan, Demeso, Hyadur, sulfinylbismethane

Molecular Formula: C2H6OSMolecular Weight: 78.133440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: IAZDPXIOMUYVGZ-UHFFFAOYSA-N

• Dipentaerythritol
IUPAC Name: 2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol | CAS Registry Number: 126-58-9
Synonyms: Dipentek, DIPENTAERYTHRITOL, Bis(pentaerythritol), Dipentaerythritol (8CI), HSDB 5610, D203203_ALDRICH, EINECS 204-794-1, NSC 65881, NSC65881, ZINC01693058, NCGC00164220-01, 1,3-Propanediol, 2,2'-(oxybis-(methylene), LS-178798, 1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-(hydroxymethyl)-, 2,2,2',2'-Tetrakis(hydroxymethyl)-3,3'-oxydipropan-1-ol, 1,3-Propanediol, 2,2'-(oxybis(methylene))bis(2-(hydroxymethyl)-, 2,2'-[oxybis(methylene)]bis[2-(hydroxymethyl)propane-1,3-diol], 106496-91-7, 110369-41-0, 115986-73-7

Molecular Formula: C10H22O7Molecular Weight: 254.277480 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 7

InChIKey: TXBCBTDQIULDIA-UHFFFAOYSA-N

• Dl Mandelic Acid
IUPAC Name: 2-hydroxy-2-phenylacetic acid | CAS Registry Number: 611-72-3
Synonyms: MANDELIC ACID, dl-Mandelic acid, Uromaline, Amygdalic acid, Almond acid, p-Mandelic acid, Phenylglycolic acid, Mandelsaeure, Paramandelic acid, Amygdalinic acid, L-mandelic acid, Racemic mandelic acid, Phenylhydroxyacetic acid, Glycolic acid, phenyl-, (RS)-Mandelic acid, Hydroxy(phenyl)acetic acid, 2-Phenylglycolic acid, (r)-mandelic acid, (+-)-Mandelic acid, (S)-Mandelic acid

Molecular Formula: C8H8O3Molecular Weight: 152.147320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IWYDHOAUDWTVEP-UHFFFAOYSA-N

• Edetic Acid
IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid | CAS Registry Number: 60-00-4
Synonyms: Edetic acid, Edathamil, Endrate, EDTA, Versene acid, Sequestrol, Titriplex, Havidote, Cheelox, Versene, Sequestric acid, Warkeelate acid, Gluma cleanser, Sequestrene aa, Universne acid, Komplexon ii, Quastal Special, Tetrine acid, Dissolvine E, Trilon bw

Molecular Formula: C10H16N2O8Molecular Weight: 292.242640 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 10

InChIKey: KCXVZYZYPLLWCC-UHFFFAOYSA-N

• endo-(+)-3-Bromo-2-bornanone
IUPAC Name: (1S,3R,4R)-3-bromo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one | CAS Registry Number: 10293-06-8
Synonyms: ZINC00155265

Molecular Formula: C10H15BrOMolecular Weight: 231.129500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NJQADTYRAYFBJN-NYNCVSEMSA-N

• Ethyl 2-cyano-3,3-diphenylacrylate
IUPAC Name: ethyl 2-cyano-3,3-di(phenyl)prop-2-enoate | CAS Registry Number: 5232-99-5
Synonyms: Etocrylene, Etocrilene, UV Absorber-2, Uvinul N 35, Etocrylene [USAN], Etocrilene (INN), Etocrylene (USAN), Etocrilenum [INN-Latin], Etocrileno [INN-Spanish], CE 2, USAF A-15972, HSDB 7218, Ethyl (diphenylmethylene)cyanoacetate, 415812_ALDRICH, EINECS 226-029-0, NSC 52678, NSC52678, BRN 1885803, ZINC00001404, Ethyl 2-cyano-3,3-diphenyl-2-propenoate

Molecular Formula: C18H15NO2Molecular Weight: 277.317200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: IAJNXBNRYMEYAZ-UHFFFAOYSA-N

• Ethyl 4-Bromobutyrate
IUPAC Name: ethyl 4-bromobutanoate | CAS Registry Number: 2969-81-5
Synonyms: Ethyl 4-bromobutyrate, Ethyl 4-bromobutanoate, BrCH2CH2CH2C(O)OC2H5, 167118_ALDRICH, EINECS 221-005-6, NSC133462, ZINC01720175, Butanoic acid, 4-bromo-, ethyl ester, NSC 133462, AI3-36601, Butanoic acid, 4-bromo-, ethyl ester (9CI), B-5800

Molecular Formula: C6H11BrO2Molecular Weight: 195.054340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XBPOBCXHALHJFP-UHFFFAOYSA-N

• Ethyl Bromoacetate
IUPAC Name: ethyl 2-bromoacetate | CAS Registry Number: 105-36-2
Synonyms: Ethyl bromoacetate, Antol, Ethyl bromacetate, Ethyl monobromoacetate, Ethyl alpha-bromoacetate, Ethoxycarbonylmethyl bromide, Acetic acid, bromo-, ethyl ester, ETHYL 2-BROMOACETATE, Bromoacetic acid, ethyl ester, Ethyl .alpha.-bromoacetate, Bromoacetic acid ethyl ester, CCRIS 6802, WLN: E1VO2, HSDB 5069, 133973_ALDRICH, NSC 8832, 17020_FLUKA, EINECS 203-290-9, NSC8832, UN1603

Molecular Formula: C4H7BrO2Molecular Weight: 167.001180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PQJJJMRNHATNKG-UHFFFAOYSA-N

• Ethyl Bromoisobutyrate
IUPAC Name: ethyl 2-bromo-2-methylpropanoate | CAS Registry Number: 600-00-0
Synonyms: Ethyl 2-bromoisobutyrate, Ethyl .alpha.-bromoisobutyrate, 6-Hydroxydopamine bromide, Ethyl 2-bromo-2-methylpropionate, E14403_ALDRICH, Ethyl 2-bromo-2-methylpropanoate, CCRIS 6546, ETHYL ALPHA-BROMOISOBUTYRATE, 17440_FLUKA, NSC9465, NSC 9465, EINECS 209-980-6, NSC402034, ZINC01699997, Propanoic acid, 2-bromo-2-methyl-, ethyl ester, alpha-Bromoisobutyric acid, ethyl ester, NSC 402034, Ethyl alpha-bromo-alpha-methylpropionate, 2-Bromo-2-methylpropanoic acid, ethyl ester, .alpha.-Bromoisobutyric acid, ethyl ester

Molecular Formula: C6H11BrO2Molecular Weight: 195.054340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IOLQWGVDEFWYNP-UHFFFAOYSA-N

• Ethyl Triphenyl Phosphonium Iodide
IUPAC Name: ethyl(triphenyl)phosphanium iodide | CAS Registry Number: 4736-60-1
Synonyms: Ethyltriphenylphosphonium iodide, Phenylphosphonium ethyl iodide, Triphenylethylphosphonium iodide, EINECS 225-245-2, Phosphonium, ethyltriphenyl-, iodide, LS-106911, TL8003222

Molecular Formula: C20H20IPMolecular Weight: 418.251031 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SLAFUPJSGFVWPP-UHFFFAOYSA-M

• Ethyl Triphenylphosphonium Bromide
IUPAC Name: ethyl(triphenyl)phosphanium bromide | CAS Registry Number: 1530-32-1
Synonyms: Ethyl (trimethylsilyl)acetate, Ethyltriphenylphosphonium bromide, Triphenylethylphosphonium bromide, CID73727, NSC60660, EINECS 216-223-3, Phosphonium, ethyltriphenyl-, bromide, ST5406391, TL8001138

Molecular Formula: C20H20BrPMolecular Weight: 371.250561 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JHYNXXDQQHTCHJ-UHFFFAOYSA-M

• Ethylene Urea
IUPAC Name: imidazolidin-2-one | CAS Registry Number: 120-93-4
Synonyms: 2-Imidazolidone, 2-Imidazolidinone, ETHYLENEUREA, Ethylene urea, Monoethyleneurea, N,N'-Ethyleneurea, 2-Oxoimidazolidine, imidazolidin-2-one, 1,3-Ethyleneurea, 2-Oxomidazolidine, Imidazolid-2-one, Urea, 1,3-ethylene-, WLN: T5MVMTJ, I601_ALDRICH, HSDB 4021, Urea, N,N'-(1,2-ethanediyl)-, CHEBI:37001, EINECS 204-436-4, SD 6073, NSC3338

Molecular Formula: C3H6N2OMolecular Weight: 86.092540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: YAMHXTCMCPHKLN-UHFFFAOYSA-N

• Fischres Aldehyde
IUPAC Name: (2Z)-2-(1,3,3-trimethylindol-2-ylidene)acetaldehyde | CAS Registry Number: 84-83-3
Synonyms: Tribasenaldehyde, Fisher's aldehyde, Fischer's aldehyde, MLS001013303, EINECS 201-565-8, NSC 68048, ZINC04579169, LS-7907, 2-(Formylmethylene)-1,3,3-trimethylindoline, SMR000385325, (1,3,3-Trimethylindolin-2-ylidene)acetaldehyde, ST5214603, 1,3,3-Trimethyl-delta2,alpha-indolineacetaldehyde, 1,3,3-TRIMETHYL-2-(FORMYLMETHYLENE)INDOLINE, Acetaldehyde, (1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-, 1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene acetaldehyde, delta2,alpha-Indolineacetaldehyde, 1,3,3-trimethyl-, (1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)acetaldehyde, .DELTA.2,.alpha.-Indolineacetaldehyde, 1,3,3-trimethyl-, delta(sup 2,alpha)-Indolinacetaldehyde, 1,3,3-trimethyl-

Molecular Formula: C13H15NOMolecular Weight: 201.264300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GCECACVNILMTRD-WQLSENKSSA-N

• Fluorobenzene
IUPAC Name: fluorobenzene | CAS Registry Number: 462-06-6
Synonyms: FLUOROBENZENE, Benzene, fluoro-, Phenyl fluoride, Monofluorobenzene, Fluorbenzol, WLN: FR, F6001_ALDRICH, 47321_SUPELCO, CHEBI:5115, 46660_FLUKA, 46662_FLUKA, 51411_FLUKA, EINECS 207-321-7, NSC 68416, UN2387, CID10008, CPD-8871, NSC68416, AI3-28560, LS-1273

Molecular Formula: C6H5FMolecular Weight: 96.102303 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PYLWMHQQBFSUBP-UHFFFAOYSA-N

• Guanidine Nitrate
IUPAC Name: guanidine; nitric acid | CAS Registry Number: 506-93-4
Synonyms: Guanidine nitrate, Guanidinium nitrate, Guanidine mononitrate, Guanidine, nitrate, GUANIDINE, MONONITRATE, Guanidine nitrate (1:1), GAUNIDINE NITRATE, HSDB 5671, 234249_ALDRICH, NSC 7295, 50970_FLUKA, EINECS 208-060-1, NSC7295, UN1467, CID10481, AI3-15039, Guanidine nitrate [UN1467] [Oxidizer], LS-73823, Guanidine nitrate [UN1467] [Oxidizer], TL8003362

Molecular Formula: CH6N4O3Molecular Weight: 122.083340 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: CNUNWZZSUJPAHX-UHFFFAOYSA-N

• Hypophosphorous Acid
IUPAC Name: hydroxy(oxo)phosphanium | CAS Registry Number: 6303-21-5
Synonyms: Phosphinic acid, Hyopophosphite, Phosphinate, Hypophosphorous acid, Hypophosphorous acid (NF), HPH2O2, dihydridodioxophosphoric acid, H2PO(OH), dihydridohydroxidooxidophosphorus, [PH2(OH)O], [PH2O(OH)], CHEBI:29031, hydrogen dihydridodioxophosphate(1-), C05339, D02334

Molecular Formula: H2O2P+Molecular Weight: 64.988441 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GFYXELHUDBJJEV-UHFFFAOYSA-O

• Indole-2-Carboxylic Acid
IUPAC Name: 1H-indole-2-carboxylic acid | CAS Registry Number: 1477-50-5
Synonyms: 2-Carboxyindole, Indole-2-carboxylic acid, 2-Indolecarboxylic acid, 1H-Indole-2-carboxylic acid, Spectrum_001485, SpecPlus_000676, Spectrum2_000021, Spectrum3_000943, Spectrum4_001042, Spectrum5_001735, I5109_ALDRICH, Oprea1_557882, KBioGR_001304, KBioSS_001965, DivK1c_006772, SPECTRUM1502082, SPBio_000081, INDOLE-2-CARBOXLIC ACID, EINECS 216-030-4, KBio1_001716

Molecular Formula: C9H7NO2Molecular Weight: 161.157380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HCUARRIEZVDMPT-UHFFFAOYSA-N

• Indole-3-Carbinol
IUPAC Name: 1H-indol-3-ylmethanol | CAS Registry Number: 700-06-1
Synonyms: Indole-3-carbinol, 3-Indolylcarbinol, 3-Hydroxymethylindole, Indinol, INDOLE-3-METHANOL, 3-Indolemethanol, I3C cpd, 1H-indol-3-ylmethanol, 1H-Indole-3-methanol, Spectrum2_001710, Spectrum3_001973, C9H9NO, CCRIS 3261, BSPBio_003573, MLS001333161, MLS001333162, I7256_SIGMA, SPECTRUM1505320, SPBio_001700, Prevention 4 (indole-3-carbinol)

Molecular Formula: C9H9NOMolecular Weight: 147.173860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IVYPNXXAYMYVSP-UHFFFAOYSA-N

• Indoline 2- Carboxylic Acid
IUPAC Name: 2,3-dihydro-1H-indole-2-carboxylic acid | CAS Registry Number: 78348-24-0
Synonyms: Indoline-2-carboxylic acid, L-Indoline-2-carboxylic acid, ()-Indoline-2-carboxylic acid, 302244_ALDRICH, (-)-Indoline-2-carboxylic acid, (1)-Indoline-2-carboxylic acid, 57245_FLUKA, CID86074, EINECS 240-875-8, EINECS 278-899-6, 2,3-Dihydroindole-2-carboxylic acid, STK260845, SDCCGMLS-0065896.P001, CDS1_000178, ()-2,3-Dihydroindole-2-carboxylic acid, TL8005353, I-5090, 1H-Indole-2-carboxylic acid, 2,3-dihydro-, (.+/-.)-, 16851-56-2

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QNRXNRGSOJZINA-UHFFFAOYSA-N

• Iso-Butyryl Chloride
IUPAC Name: 2-methylpropanoyl chloride | CAS Registry Number: 79-30-1
Synonyms: Isobutyryl chloride, Isobutanoyl chloride, Isobutyric acid chloride, Isobutyroyl chloride, 2-Methylpropanoyl chloride, Dimethylacetyl chloride, Chloro isopropyl ketone, 2-Methylpropionyl chloride, alpha-Methylpropionyl chloride, PROPANOYL CHLORIDE, 2-METHYL-, 139122_ALDRICH, 58420_FLUKA, EINECS 201-194-1, UN2395, ZINC01850092, LS-123213, Isobutyryl chloride [UN2395] [Flammable liquid], Isobutyryl chloride [UN2395] [Flammable liquid], InChI=1/C4H7ClO/c1-3(2)4(5)6/h3H,1-2H, 120126-85-4

Molecular Formula: C4H7ClOMolecular Weight: 106.550780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DGMOBVGABMBZSB-UHFFFAOYSA-N

• Isopropylphenyl Phosphate
IUPAC Name: tris(4-propan-2-ylphenyl) phosphate | CAS Registry Number: 68937-41-7
Synonyms: Tris(4-isopropylphenyl) phosphate, CID75628, EINECS 219-703-0, Phenol, isopropylated, phosphate (3:1), Phenol, 4-(1-methylethyl)-, phosphate (3:1), 2502-15-0

Molecular Formula: C27H33O4PMolecular Weight: 452.522281 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ANVREEJNGJMLOV-UHFFFAOYSA-N

• m-Bromofluorobenzene
IUPAC Name: 1-bromo-3-fluorobenzene | CAS Registry Number: 1073-06-9
Synonyms: m-Fluorobromobenzene, 3-Bromofluorobenzene, m-Fluorophenyl bromide, 3-Bromfluorbenzen, Benzene, 1-bromo-3-fluoro-, 1-Fluoro-3-bromobenzene, 1-BROMO-3-FLUOROBENZENE, 3-Bromfluorbenzen [Czech], Benzene, 1-fluoro-3-bromo-, WLN: FR CE, B67007_ALDRICH, EINECS 214-023-0, NSC 10267, NSC10267, LS-30353, TL806401, ST5406324, InChI=1/C6H4BrF/c7-5-2-1-3-6(8)4-5/h1-4

Molecular Formula: C6H4BrFMolecular Weight: 174.998363 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QDFKKJYEIFBEFC-UHFFFAOYSA-N

• m-Chlorophenol
IUPAC Name: 3-chlorophenol | CAS Registry Number: 108-43-0
Synonyms: 3-Chlorophenol, Phenol, 3-chloro-, Phenol, m-chloro-, meta-Chlorophenol, m-Chlorophenic acid, 3-Hydroxychlorobenzene, m-monochlorophenol, meta-monochlorophenol, 1li3, 3-Chloro-1-hydroxybenzene, WLN: QR CG, CCRIS 641, C62808_ALDRICH, HSDB 1413, 36747_RIEDEL, 25840_FLUKA, CHEBI:38855, EINECS 203-582-6, NSC 59700, UN2020

Molecular Formula: C6H5ClOMolecular Weight: 128.556300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HORNXRXVQWOLPJ-UHFFFAOYSA-N

• M-Difluorobenzene
IUPAC Name: 1,3-difluorobenzene | CAS Registry Number: 372-18-9
Synonyms: m-Difluorobenzene, Benzene, m-difluoro-, 1,3-DIFLUOROBENZENE, Benzene, 1,3-difluoro-, meta-Difluorobenzene, 1,3-Difluorbenzol, Ambap5726, WLN: FR CF, D102008_ALDRICH, CHEBI:38584, EINECS 206-746-5, CID9741, NSC 10285, Benzene, 1,3-difluoro- (9CI), JRD-0432, NSC10285, LS-29834, TL8002738

Molecular Formula: C6H4F2Molecular Weight: 114.092766 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UEMGWPRHOOEKTA-UHFFFAOYSA-N

• Magnesium
IUPAC Name: magnesium | CAS Registry Number: 7439-95-4
Synonyms: MAGNESIUM, Magnesium sheet, magnesio, Magnesium hydride, Magnesium powdered, Magnesio [Italian], Magnesium modifier, Magnesium preparation, Rieke's active magnesium, Magnesium Matrix Modifier, 12Mg, HSDB 654, 13103_RIEDEL, 13112_RIEDEL, 254118_ALDRICH, 299405_ALDRICH, 37426_RIEDEL, 37466_RIEDEL, 37506_RIEDEL, 403148_ALDRICH

Molecular Formula: MgMolecular Weight: 24.305000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FYYHWMGAXLPEAU-UHFFFAOYSA-N

• Methyl (s)-(-)-2-chloropropionate
IUPAC Name: methyl (2S)-2-chloropropanoate | CAS Registry Number: 73246-45-4
Synonyms: CCRIS 7389, Methyl (S)-2-chloropropionate, 247030_ALDRICH, 26222_FLUKA, (S)-2-Chloropropanoic acid methyl ester, ZINC01696573, LS-188759, (−)-Methyl (S)-2-chloropropionate, Propanoic acid, 2-chloro-, methyl ester, (2S)-, 17639-93-9

Molecular Formula: C4H7ClO2Molecular Weight: 122.550180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JLEJCNOTNLZCHQ-VKHMYHEASA-N

• Methyl 2-Bromo Hexanoate (Caproate)
IUPAC Name: methyl 2-bromohexanoate | CAS Registry Number: 5445-19-2
Synonyms: Methyl 2-bromohexanoate, Methyl 2-bromocaproate, 16602_FLUKA, NSC21976, EINECS 226-643-9, 70288-61-8

Molecular Formula: C7H13BrO2Molecular Weight: 209.080920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YGLPDRIMFIXNBI-UHFFFAOYSA-N

• Methyl 2-Bromobutyrate
IUPAC Name: methyl 2-bromobutanoate | CAS Registry Number: 3196-15-4
Synonyms: Methyl 2-bromobutanoate, Methyl 2-bromobutyrate, 237310_ALDRICH, Butanoic acid, 2-bromo-, methyl ester, NSC21974, EINECS 221-699-0, NSC 21974, T5556360, InChI=1/C5H9BrO2/c1-3-4(6)5(7)8-2/h4H,3H2,1-2H, 69043-96-5

Molecular Formula: C5H9BrO2Molecular Weight: 181.027760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UFQQDNMQADCHGH-UHFFFAOYSA-N

• Methyl 2-Bromopropionate
IUPAC Name: methyl (2S)-2-bromopropanoate | CAS Registry Number: 5445-17-0
Synonyms: Methyl 2-bromopropanoate, ZINC01589664, Propanoic acid, 2-bromo-, methyl ester, InChI=1/C4H7BrO2/c1-3(5)4(6)7-2/h3H,1-2H

Molecular Formula: C4H7BrO2Molecular Weight: 167.001180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ACEONLNNWKIPTM-VKHMYHEASA-N

• Methyl-P-Nitrobenzoate
IUPAC Name: methyl 4-nitrobenzoate | CAS Registry Number: 619-50-1
Synonyms: Methyl 4-nitrobenzoate, METHYL P-NITROBENZOATE, Methyl-p-nitrobenzoate, p-Carbomethoxynitrobenzene, Methyl p-nitro benzoate, Benzoic acid, 4-nitro-, methyl ester, WLN: WNR DVO1, p-Nitrobenzoic acid methyl ester, Benzoic acid, p-nitro-, methyl ester, 72962_ALDRICH, ARONIS007141, NSC 4137, EINECS 210-599-2, NSC4137, ZINC00556156, AI3-02241, LS-38024, ST5331833, TL8003990, AB-131/40897075

Molecular Formula: C8H7NO4Molecular Weight: 181.145480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: YOJAHJGBFDPSDI-UHFFFAOYSA-N

• Methyltriphenylphosphonium Bromide
IUPAC Name: methyl(triphenyl)phosphanium bromide | CAS Registry Number: 1779-49-3
Synonyms: Methyltriphenylphosphonium bromide, Triphenylmethylphosphonium bromide, Methyl triphenylphosphonium bromide, 130079_ALDRICH, Phosphonium, methyltriphenyl-, bromide, NSC20740, EINECS 217-218-9, NSC 20740, NSC102058, NSC 102058, ST5406600, 131507-02-3, 15912-74-0

Molecular Formula: C19H18BrPMolecular Weight: 357.223981 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LSEFCHWGJNHZNT-UHFFFAOYSA-M

• N-Butyl Benzene
IUPAC Name: butylbenzene | CAS Registry Number: 104-51-8
Synonyms: Butylbenzene, N-BUTYLBENZENE, 1-Phenylbutane, Benzene, butyl-, 1-Butylbenzene, B90203_ALDRICH, WLN: 4R, HSDB 7211, 47322_SUPELCO, NSC 8465, 19600_FLUKA, 19610_FLUKA, CHEBI:44194, EINECS 203-209-7, CID7705, NSC8465, BRN 1903395, Benzene, butyl-, branched and linear, AI3-00119, DB01845

Molecular Formula: C10H14Molecular Weight: 134.218160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: OCKPCBLVNKHBMX-UHFFFAOYSA-N

• N-Methyl-2-PhenylIndole
IUPAC Name: 1-methyl-2-phenylindole | CAS Registry Number: 3558-24-5
Synonyms: 1-Methyl-2-phenylindole, 2-Phenyl-N-methylindole, Indole, 1-methyl-2-phenyl-, 1-Methyl-2-phenyl-1H-indole, 1H-Indole, 1-methyl-2-phenyl-, NCIOpen2_002836, MLS001215074, 404888_ALDRICH, NSC63793, CID77095, EINECS 222-618-1, NSC 63793, ZINC01081188, Indole, 1-methyl-2-phenyl- (8CI), SMR000543310, ST5307707, AF-963/00522046, InChI=1/C15H13N/c1-16-14-10-6-5-9-13(14)11-15(16)12-7-3-2-4-8-12/h2-11H,1H

Molecular Formula: C15H13NMolecular Weight: 207.270420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SFWZZSXCWQTORH-UHFFFAOYSA-N

• Naphthalene-1,5-Disulphonic Acid Disodium Salt
IUPAC Name: disodium naphthalene-1,5-disulfonate | CAS Registry Number: 1655-29-4
Synonyms: 250899_ALDRICH, 70240_FLUKA, Sodium 1,5-naphthalenedisulfonate, Disodium 1,5-naphthalenedisulfonate, EINECS 216-732-0, NSC 12189, Disodium naphthalene-1,5-disulphonate, Sodium 1,5-naphthalenedisulfonate dibasic, ST5411850, 1,5-Naphthalenedisulfonic acid disodium salt, 1,5-Naphthalenedisulfonic acid, disodium salt, 1,5-Naphthalenedisulfonic acid, monosodium salt, Sodium salt of naphthalene-1,5-disulfonic acid, 1,5-Naphthalenedisulfonic acid disodium salt hydrate, 1,5-NAPHTHALENEDISULFONIC ACID, Na SALT, TECH

Molecular Formula: C10H6Na2O6S2Molecular Weight: 332.260580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: YGSZNSDQUQYJCY-UHFFFAOYSA-L


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