JiangXi Benniu Pharmaceutical Co.,Ltd

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Profile: JiangXi Benniu Pharmaceutical Co.,Ltd manufactures fine chemicals. Alcohol aldehyde & acid series include (1-benzyl-4-piperidyl)methanol, N-benzylpiperidine-4-carboxaldehyde, 2,6-difluorobenzyl alcohol, 2-methyl-3-nitrobenzyl alcohol, (S)-3-amino-3-phenylpropanoic acid, (S)-3-amino-3-phenylpropan-1-ol and BOC-D-phenylglycinol. Alkyl aryl sodium sulfonate series include sodium pentanesulfonate, sodium 1-hexanesulfonate, sodium 1-heptanesulfonate and sodium 1-octanesulfonate.

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• Acetyl-3,5-dinitro-4-hydroxy-L-phenylalanine
IUPAC Name: 2-acetamido-3-(4-hydroxy-3,5-dinitrophenyl)propanoic acid | CAS Registry Number: 20767-00-4
Synonyms: NCIOpen2_009100, NSC83259, N-Acetyl-3,5-dinitro-l-tyrosine, CID256409, SBB015426

Molecular Formula: C11H11N3O8Molecular Weight: 313.220340 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: CFKZKLOBRPCKTF-UHFFFAOYSA-N

• Allylestrenol
IUPAC Name: (8R,9S,10R,13S,14S,17R)-13-methyl-17-prop-2-enyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol | CAS Registry Number: 432-60-0
Synonyms: allylestrenol, Gestanin, Gestanol, Gestanon, Gestanyn, Orageston, Organon, Turinal, Allyloestrenol, Gestormone, Perselin, Allyloestrenolum, Estrenol, allyl-, Gestanon-r, Perselin (TN), 17alpha-Allylestrenol, Allilestrenolo [DCIT], 17.alpha.-Allylestrenol, Allylestrenol (JAN/INN), Allylestrenol [INN:JAN]

Molecular Formula: C21H32OMolecular Weight: 300.478180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: ATXHVCQZZJYMCF-XUDSTZEESA-N

• Benzo(b)thiophene-2-carboxylic acid
IUPAC Name: 1-benzothiophene-2-carboxylic acid | CAS Registry Number: 6314-28-9
Synonyms: Thianaphthene-2-carboxylic acid, Maybridge1_002631, Benzo[b]thiophene-2-carboxylic acid, DivK1c_001383, Thionapthene-2-carboxylic acid, 467464_ALDRICH, Thionaphthene-2-carboxylic acid, Benzothiophene-2-carboxylic acid, AIDS209139, 1-Benzothiophene-2-carboxylic acid, AIDS-209139, NSC40258, NSC 40258, NSC112990, SBB003763, BL 5583, BL-5583, NSC 112990, SDCCGMLS-0065962.P001, CDS1_000343

Molecular Formula: C9H6O2SMolecular Weight: 178.207740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DYSJMQABFPKAQM-UHFFFAOYSA-N

• Benzo[b]thiophene-2-carbonitrile
IUPAC Name: 1-benzothiophene-2-carbonitrile | CAS Registry Number: 55219-11-9

Molecular Formula: C9H5NSMolecular Weight: 159.207700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RCYHXESNWFYTCU-UHFFFAOYSA-N

• BOC-L-Phenylalaninol
IUPAC Name: tert-butyl N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]carbamate | CAS Registry Number: 66605-57-0
Synonyms: Boc-D-phenylalaninol, Boc-L-phenylalaninol, 421685_ALDRICH, 479594_ALDRICH, 15489_FLUKA, ZINC02554976, N-(tert-Butoxycarbonyl)-D-phenylalaninol, N-(tert-Butoxycarbonyl)-L-phenylalaninol, (R)-2-(Boc-amino)-3-phenyl-1-propanol, (S)-2-(Boc-amino)-3-phenyl-1-propanol, A00222, (R)-()-2-(tert-Butoxycarbonylamino)-3-phenyl-1-propanol, (S)-(−)-2-(tert-Butoxycarbonylamino)-3-phenyl-1-propanol

Molecular Formula: C14H21NO3Molecular Weight: 251.321440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: LDKDMDVMMCXTMO-LBPRGKRZSA-N

• Cyclohexylmethanol
IUPAC Name: cyclohexylmethanol | CAS Registry Number: 100-49-2
Synonyms: Cyclohexylcarbinol, Cyclohexanecarbinol, CYCLOHEXANEMETHANOL, Hexahydrobenzyl alcohol, Methanol, cyclohexyl-, Cyclohexylmethyl alcohol, (Hydroxymethyl)cyclohexane, Cyclohexyl methanol, Hydroxymethylcyclohexane, Benzyl alcohol, hexahydro-, USAF DO-49, CYCLOHEXYL CARBINOL, WLN: L6TJ A1Q, C105805_ALDRICH, NSC 5288, 55640_FLUKA, EINECS 202-857-8, NSC5288, BRN 0773712, ZINC01680819

Molecular Formula: C7H14OMolecular Weight: 114.185460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VSSAZBXXNIABDN-UHFFFAOYSA-N

• dapoxetine
IUPAC Name: (1S)-N,N-dimethyl-3-naphthalen-1-yloxy-1-phenylpropan-1-amine | CAS Registry Number: 119356-77-3
Synonyms: Dapoxetine, Dapoxetine [INN], Dapoxetinum [INN-Latin], Dapoxetina [INN-Spanish], LY210448, LY 210448, LS-30482, Benzenemethanamine, N,N-dimethyl-alpha-(2-(1-naphthalenyloxy)ethyl)-, (+)-, 129938-20-1

Molecular Formula: C21H23NOMolecular Weight: 305.413420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: USRHYDPUVLEVMC-FQEVSTJZSA-N

• Dapoxetine Hydrochloride
IUPAC Name: (1S)-N,N-dimethyl-3-naphthalen-1-yloxy-1-phenylpropan-1-amine | CAS Registry Number: 129938-20-1
Synonyms: Dapoxetine, Dapoxetine [INN], Dapoxetinum [INN-Latin], Dapoxetina [INN-Spanish], LY210448, LY 210448, LS-30482, Benzenemethanamine, N,N-dimethyl-alpha-(2-(1-naphthalenyloxy)ethyl)-, (+)-, 119356-77-3

Molecular Formula: C21H23NOMolecular Weight: 305.413420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: USRHYDPUVLEVMC-FQEVSTJZSA-N

• Estr-4-en-17-one
IUPAC Name: (8R,9S,10R,13S,14S)-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one | CAS Registry Number: 3846-28-4
Synonyms: estr-4-en-17-one, 3646-28-4, Oestr-4-en-17-one, AC1L325J, SCHEMBL7861153, CTK1C2198, EINECS 222-878-6, AR-1I7199, ZINC06067852, DB-001360, 3B3-064603, (1S,2R,10R,11S,15S)-15-methyltetracyclo[8.7.0.0?,?.0??,??]heptadec-6-en-14-one, (8R,9S,10R,13S,14S)-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one

Molecular Formula: C18H26OMolecular Weight: 258.398440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: OLYAEHZZXXLNQQ-QXUSFIETSA-N

• Ethyl 2-(acetylamino)-3-[3,5-diamino-4-(4-methoxyphenoxy)phenyl]propanoate
IUPAC Name: ethyl (2S)-2-acetamido-3-[3,5-diamino-4-(4-methoxyphenoxy)phenyl]propanoate | CAS Registry Number: 440667-78-7
Synonyms: SCHEMBL7631233, CA-510, AJ-32775, Ac-3,5-diamino-4-(4-methoxyphenoxy)-Phe-OEt, Ethyl2- -3-[3,5-diamino-4- phenyl]propanoate

Molecular Formula: C20H25N3O5Molecular Weight: 387.429600 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: HSPGVWWLMFCIKW-SFHVURJKSA-N

• Ethyl 2-(acetylamino)-3-[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]propanoate
IUPAC Name: ethyl 2-acetamido-3-[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]propanoate | CAS Registry Number: 83249-56-3
Synonyms: NSC97077, MolPort-001-783-525, CID417971, KM08406

Molecular Formula: C20H21I2NO5Molecular Weight: 609.193380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: LCJKMEUFNHSFPB-UHFFFAOYSA-N

• Ethyl 2-amino-1-cyclopentene-1-carboxylate
IUPAC Name: ethyl 2-aminocyclopentene-1-carboxylate | CAS Registry Number: 7149-18-0
Synonyms: Oprea1_395378, AA007, NSC52925, MolPort-002-054-034, CID243333, ZINC00162152, Cyclopentene-1-carboxylic acid, 2-amino-, ethyl ester

Molecular Formula: C8H13NO2Molecular Weight: 155.194320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FMEHILPGLKGSCA-UHFFFAOYSA-N

• Ethyl 5-nitroindole-2-carboxylate
IUPAC Name: ethyl 5-nitro-1H-indole-2-carboxylate | CAS Registry Number: 16732-57-3
Synonyms: Oprea1_174962, JFD 01905, NSC131897, SBB012437, ZINC00153779, N-3303

Molecular Formula: C11H10N2O4Molecular Weight: 234.208100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: DVFJMQCNICEPAI-UHFFFAOYSA-N

• Levothyroxine Sodium
IUPAC Name: sodium (2S)-2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoate | CAS Registry Number: 55-03-8
Synonyms: Thyradin, eltroxin, levothroid, Levoroxine, Thyronamin, Thyroxevan, Dathroid, Euthyrox, Laevoxin, Tiroidina, Unithroid, Levaxin, Levoxyl, Oroxine, Roxstan, Tetroid, Letter, Sodium thyroxin, Thyroxin sodium, Ro-thyroxine

Molecular Formula: C15H10I4NNaO4Molecular Weight: 798.851850 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: YDTFRJLNMPSCFM-YDALLXLXSA-M

• N,n-dipropyl-2-methyl-3-nitrophenylethanamine
IUPAC Name: N-[2-(2-methyl-3-nitrophenyl)ethyl]-N-propylpropan-1-amine | CAS Registry Number: 91374-23-1
Synonyms: N-(2-methyl-3-nitrophenethyl)-N-propylpropan-1-amine, Benzeneethanamine, 2-methyl-3-nitro-N,N-dipropyl-, [2-(2-Methyl-3-nitro-phenyl)-ethyl]-dipropyl-amine, N-(2-Methyl-3-nitrophenethyl)-N-propylpropan-1-amine hydrochloride, PubChem13926, AGN-PC-00LZPZ, SureCN3841214, CTK6E4245, MolPort-003-987-441, ACT05040, ANW-45345, SBB064101, AKOS015890002, AG-B-31883, BD23106, RP29423, AK-59619, AB1004804, TL8005861, AM20041397

Molecular Formula: C15H24N2O2Molecular Weight: 264.363260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YTNVHUSMDIAWLT-UHFFFAOYSA-N

• N-Benzyl piperidine-4-carboxaldehyde
IUPAC Name: 1-(phenylmethyl)piperidine-4-carbaldehyde | CAS Registry Number: 22065-85-6
Synonyms: ZERO/005913, 1-Benzylpiperidine-4-carbaldehyde, 664081_ALDRICH, N-Benzylpiperidine-4-carboxaldehyde, ALBB-006394, CID89584, EINECS 244-757-7

Molecular Formula: C13H17NOMolecular Weight: 203.280180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SGIBOXBBPQRZDM-UHFFFAOYSA-N

• N-boc D-Prolinol
IUPAC Name: tert-butyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate | CAS Registry Number: 83435-58-9
Synonyms: N-Boc-D-prolinol, N-t-Boc-D-prolinol, MLS001332407, MLS001332408, 469440_ALDRICH, ZINC00057019, CID688279, (R)-()-1-Boc-2-pyrrolidinemethanol, (R)-(+)-1-Boc-2-pyrrolidinemethanol, NCGC00166099-01, SMR000857152, (R)-()-1-(tert-Butoxycarbonyl)-2-pyrrolidinemethanol

Molecular Formula: C10H19NO3Molecular Weight: 201.262760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BFFLLBPMZCIGRM-MRVPVSSYSA-N

• N-boc L-Prolinol
IUPAC Name: tert-butyl (2S)-2-(hydroxymethyl)pyrrolidine-1-carboxylate | CAS Registry Number: 69610-40-8
Synonyms: Boc-L-Prolinol, N-Boc-L-prolinol, 446327_ALDRICH, ARK001, (S)-1-Boc-2-pyrrolidinemethanol, CID643448, ZINC00057018, ZINC00057019, ST5307674, tert-butyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate, 1-pyrrolidinecarboxylic acid, 2-(hydroxymethyl)-, 1,1-dimethylethyl ester, InChI=1/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h8,12H,4-7H2,1-3H

Molecular Formula: C10H19NO3Molecular Weight: 201.262760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BFFLLBPMZCIGRM-QMMMGPOBSA-N

• R-(-)-5-(2-Amino-Propyl)-2-Methoxy-Benzenesulfonamide
IUPAC Name: 5-(2-aminopropyl)-2-methoxybenzenesulfonamide | CAS Registry Number: 112101-81-2
Synonyms: 5-(2-AMINOPROPYL)-2-METHOXYBENZENESULFONAMIDE, R-(-)-5-(2-Amino-propyl)-2-methoxybenzenesulfonamide, R-(-)-5-[2(2-Amino-2-Methyl)Ethyl]-2- Methory Benzene Sulfonamide, 112244-38-9, 5-[2-Aminopropyl]-2-methoxybenzenesulfonamide, AGN-PC-00LALO, ACMC-20a14k, Benzenesulfonamide,5-[(2R)-2-aminopropyl]-2-methoxy-, R-(-)-5-(2-Amino-propyl)-2-methoxy-benzenesulfonamide, SureCN1412240, 5-[(2R)-2-AMINOPROPYL]-2-METHOXYBENZENESULFONAMIDE, MolPort-003-848-659, ANW-51025, AKOS015914394, AC-5617, AK-25296, R253, KB-195581, 5-(2-Aminopropyl)-2-methoxybenzenesulphonamide, M-1660

Molecular Formula: C10H16N2O3SMolecular Weight: 244.310640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: IORITYIZDHJCGT-UHFFFAOYSA-N

• Ropinirole HCL
IUPAC Name: 4-[2-(dipropylamino)ethyl]-1,3-dihydroindol-2-one hydrochloride | CAS Registry Number: 91374-20-8
Synonyms: ReQuip, Ropinirole hydrochloride, Adartrel, Repreve, ReQuip CR, ReQuip LP, ReQuip XL, ReQuip XR, Requip (TN), JZP-7, C16H24N2O.HCl, Ropinirole hydrochloride [USAN], NVD-434, SK&F 101468-A, Ropinirole hydrochloride (JAN/USAN), SK&F-101468A, NCGC00094373-01, LS-83828, TL8005858, EU-0101101

Molecular Formula: C16H25ClN2OMolecular Weight: 296.835500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XDXHAEQXIBQUEZ-UHFFFAOYSA-N

• Rufinamide
IUPAC Name: 1-[(2,6-difluorophenyl)methyl]triazole-4-carboxamide | CAS Registry Number: 106308-44-5
Synonyms: Inovelon, Banzel, Xilep, Rufinamide (USAN/INN), MLS001332513, MLS001332514, R8404_SIGMA, Cgp 33101, RUF-331, SYN-111, CGP-33101, NCGC00165883-01, NCGC00165883-02, SMR000857122, D05775, E-2080, 1-(2,6-Difluorobenzyl)-1H-1,2,3-triazole-4-carboxamide, 1-[(2,6-difluorophenyl)methyl]-1H-1,2,3-Triazole-4-carboxamide, 1H-1,2,3-Triazole-4-carboxamide, 1-((2,6-difluorophenyl)methyl)-

Molecular Formula: C10H8F2N4OMolecular Weight: 238.193526 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: POGQSBRIGCQNEG-UHFFFAOYSA-N

• Sodium Cyanoborohydride
IUPAC Name: sodium; boron(3+); hydride; cyanide | CAS Registry Number: 25895-60-7
Synonyms: sodium cyanoborohydride, Sodium cyanotrihydroborate, EINECS 247-317-2, LS-191223, Borate(1-), (cyano-kappaC)trihydro-, sodium, (T-4)-

Molecular Formula: CH3BNNaMolecular Weight: 62.841990 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IVGYREMSCQFSBM-UHFFFAOYSA-N

• Sodium Triacetoxyborohydride
IUPAC Name: sodium triacetyloxyboranuide | CAS Registry Number: 56553-60-7
Synonyms: Sodium triacetoxyborohydride, 316393_ALDRICH, 72062_FLUKA, CID2724941, CID5049666, Borate(1-), tris(acetato-kappaO)hydro-, sodium, (T-4)-, 824402-68-8

Molecular Formula: C6H10BNaO6Molecular Weight: 211.940770 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: HHYFEYBWNZJVFQ-UHFFFAOYSA-N

• Tamsulosin
IUPAC Name: 5-[(2R)-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide | CAS Registry Number: 106133-20-4
Synonyms: TAMSULOSIN, Flomax, Tamsulosine [INN-French], Tamsulosinum [INN-Latin], Tamsulosin [INN:BAN], Tamsulosina [INN-Spanish], TAMSULOSIN HYDROCHLORIDE, CHEBI:9398, STOCK6S-44591, C20H28N2O5S, DB00706, NCGC00167442-01, LS-31578, C07124, (R)-5-(2-((2-(2-Ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide, Benzenesulfonamide, 5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxy-, (R)-, 5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide, 5-[2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxy-benzenesulfonamide, 5-[(2R)-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide, 5-[(2R)-2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl]-2-methoxybenzenesulfonamide

Molecular Formula: C20H28N2O5SMolecular Weight: 408.511720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: DRHKJLXJIQTDTD-OAHLLOKOSA-N

• Tolterodine L-tartrate
IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid; 2-[(1S)-3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol | CAS Registry Number: 124937-52-6
Synonyms: Detrusitol, Detrol, Tolterodine tartrate, Detrol LA, Detrusitol (TN), Detrol (TN), Tolterodine tartrate [USAN], Tolterodine tartrate (JAN/USAN), PNU 200583E, D01148, Phenol, 2-((1R)-3-(bis(1-methylethyl)amino)-1-phenylpropyl)-4-methyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt), Phenol, 2-(3-(bis(1-methylethyl)amino)-1-phenylpropyl)-4-methyl-, (R)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (1:1) (salt)

Molecular Formula: C26H37NO7Molecular Weight: 475.574480 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 8

InChIKey: TWHNMSJGYKMTRB-CDHDNNKHSA-N

• Triphenylacetic acid
IUPAC Name: 2,2,2-tri(phenyl)acetic acid | CAS Registry Number: 595-91-5
Synonyms: Tritylformic acid, Acetic acid, triphenyl-, Maybridge1_006927, NSC61, T81205_ALDRICH, NSC 61, Acetic acid, triphenyl- (8CI), AIDS017628, AIDS-017628, EINECS 209-873-4, SBB008604, Benzeneacetic acid, .alpha.,.alpha.-diphenyl-, alpha-Toluic acid, alpha,alpha-diphenyl-, Benzeneacetic acid, alpha,alpha-diphenyl-, AI3-05839, .alpha.-Toluic acid, .alpha.,.alpha.-diphenyl-

Molecular Formula: C20H16O2Molecular Weight: 288.339840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DCYGAPKNVCQNOE-UHFFFAOYSA-N

• Venlafaxine HCL
IUPAC Name: 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol hydrochloride | CAS Registry Number: 99300-78-4
Synonyms: Effexor, Effexor XR, venlafaxine, Trevilor, Dobupal, Efectin, Vandral, Efexor, Venlafaxine EA, Venlafaxin HCL, Venlafaxine hydrochloride, Effexor LP, Effexor XL, VENLAFAXINE HCl, Effexor (TN), C17H27NO2.HCl, HSDB 6699, MLS001401454, Venlafaxine hydrochloride [USAN], Wy-45030

Molecular Formula: C17H28ClNO2Molecular Weight: 313.862720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QYRYFNHXARDNFZ-UHFFFAOYSA-N

• 3-(2-Methoxy-5-Methylphenyl)-3-Phenyl Propanol
IUPAC Name: 2-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol;hydrochloride | CAS Registry Number: 124936-75-0
Synonyms: 2-[3-[BIS(1-METHYLETHYL)AMINO]-1-PHENYLPROPYL]-4-METHYLPHENOL HYDROCHLORIDE, 2-(3-(Diisopropylamino)-1-phenylpropyl)-4-methylphenol hydrochloride, 2-[3-(DIISOPROPYLAMINO)-1-PHENYLPROPYL]-4-METHYLPHENOL HYDROCHLORIDE, C22H32ClNO, SCHEMBL4840247, CHEMBL3183237, MolPort-003-666-559, ACT04385, 4724AA, ANW-58952, CCG-39588, AKOS016002153, VZ23427, NCGC00094575-01, AK-55863, OR070167, OR149319, AX8001519, KB-166571, TC-147697

Molecular Formula: C22H32ClNOMolecular Weight: 361.954 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FSUOGWPKKKHHHM-UHFFFAOYSA-N

• 2,3,4-Trifluorobenzyl Alcohol
IUPAC Name: (2,3,4-trifluorophenyl)methanol | CAS Registry Number: 144284-24-2
Synonyms: 2,3,4-Trifluorobenzyl alcohol, ZINC02575077, JRD-0223, CID2777027, LT03496902

Molecular Formula: C7H5F3OMolecular Weight: 162.109210 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LOZFHOHUIYBNCJ-UHFFFAOYSA-N

• (R)-N-(tert-Butoxycarbonyl)-2-phenylglycinol
IUPAC Name: tert-butyl N-[(1R)-2-hydroxy-1-phenylethyl]carbamate | CAS Registry Number: 102089-74-7
Synonyms: 429813_ALDRICH, ZINC02526759, (−)-N-Boc-D-alpha-phenylglycinol, (R)-(−)-2-(Boc-amino)-2-phenylethanol

Molecular Formula: C13H19NO3Molecular Weight: 237.294860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IBDIOGYTZBKRGI-NSHDSACASA-N

• 3,5-Diiodi-L-thyronine
IUPAC Name: 2-amino-3-[4-(4-hydroxyphenoxy)-3,5-diiodophenyl]propanoic acid | CAS Registry Number: 1041-01-6
Synonyms: Diiodothyronine, 3,5-Diiodothyronine, Diiodo-L-thyronine, 3,5-Diiodo-L-thyronine, L-3,5-Diiodothyronine, 3,5-Diiodo-D-thyronine, 3,5-Diiodo-DL-thyronine, SGCUT00132, NSC90468, NSC90469, to_000037, Tyrosine, O-(4-hydroxyphenyl)-3,5-diiodo-, 3,5-T2, L-Tyrosine, O-(4-hydroxyphenyl)-3,5-diiodo-, Alanine, (3,5-diiodo-4-(-p-hydroxyphenoxy)phenyl)-, Alanine, 3-[4-(p-hydroxyphenoxy)-3,5-diiodophenyl]-, L-, 534-51-0, 5563-89-3

Molecular Formula: C15H13I2NO4Molecular Weight: 525.076960 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: ZHSOTLOTTDYIIK-UHFFFAOYSA-N

• (R)-N-(tert-Butoxycarbonyl)-beta-phenylalaninol
IUPAC Name: tert-butyl N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]carbamate | CAS Registry Number: 106454-69-7
Synonyms: ZINC02558962, ST5307737

Molecular Formula: C14H21NO3Molecular Weight: 251.321440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: LDKDMDVMMCXTMO-GFCCVEGCSA-N

• (S)-1-N-Boc-2-methylpiperazine
IUPAC Name: tert-butyl (2S)-2-methylpiperazine-1-carboxylate | CAS Registry Number: 169447-70-5
Synonyms: (S)-1-Boc-2-methylpiperazine, (S)-1-N-Boc-2-Methylpiperazine, (S)-tert-butyl 2-methylpiperazine-1-carboxylate, S-1-N-Boc-2-methylpiperazine, (S)-1-BOC-2-METHYL-PIPERAZINE, Tert-butyl (2S)-2-methylpiperazine-1-carboxylate, (S)-1-N-Boc-2-methyl piperazine, (S)-2-Methyl-piperazine-1-carboxylic acid tert-butyl ester, S-1BOCMP, SureCN102292, 1,1-Dimethylethyl (2S)-2-methyl-1-piperazinecarboxylate, KSC174I3H, CTK0H4433, MolPort-000-002-260, BH115, (S)-1-N-Boc-2-methyl-piperazine, ACN-S001794, ACN-S003870, ACT04953, ANW-74992

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DATRVIMZZZVHMP-QMMMGPOBSA-N

• 2,6-Difluorobenzyl alcohol
IUPAC Name: (2,6-difluorophenyl)methanol | CAS Registry Number: 19064-18-7
Synonyms: 2,6-Difluorobenzenemethanol, Benzenemethanol, 2,6-difluoro-, JRD-0010, EINECS 242-792-2, ZINC00409199, TL8001556

Molecular Formula: C7H6F2OMolecular Weight: 144.118746 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LVICICZQETYOGS-UHFFFAOYSA-N

• 2-Ethoxybenzoic Acid
IUPAC Name: 2-ethoxybenzoic acid | CAS Registry Number: 134-11-2
Synonyms: 2-Ethoxybenzoic acid, o-Ethoxybenzoic acid, Benzoic acid, 2-ethoxy-, Benzoic acid, o-ethoxy-, O-Ethylsalicylic acid, 147494_ALDRICH, ARONIS009857, Benzoic acid, o-ethoxy- (8CI), AIDS018081, AIDS-018081, EINECS 205-130-3, NSC406710, NSC 406710, AI3-06193, ST5406553, TL8007018, 6679-84-1, InChI=1/C9H10O3/c1-2-12-8-6-4-3-5-7(8)9(10)11/h3-6H,2H2,1H3,(H,10,11

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XDZMPRGFOOFSBL-UHFFFAOYSA-N

• (S)-N-(tert-Butoxycarbonyl)-2-phenylglycinol
IUPAC Name: tert-butyl N-[(1S)-2-hydroxy-1-phenylethyl]carbamate | CAS Registry Number: 117049-14-6
Synonyms: (S)-(+)-2-(Boc-amino)-2-phenylethanol, BOC-L-Phenylglycinol, N-Boc-L-2-phenylglycinol, N-Boc-L-alpha-phenylglycinol, (S)-2-(tert-Butoxycarbonylamino)-2-phenylethanol, ST50825863, PubChem22950, BOC-PHG-OL, AC1Q1MU9, SureCN2481921, KSC496O7B, N-Boc- L -2-phenylglycinol, 429821_ALDRICH, Jsp001180, CTK3J6770, (+)-N-Boc-L-|A-phenylglycinol, MolPort-001-794-022, (+)-N-Boc-L-alpha-phenylglycinol, ACN-S003574, ACT04148

Molecular Formula: C13H19NO3Molecular Weight: 237.294860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IBDIOGYTZBKRGI-LLVKDONJSA-N

• (S)-3-Amino-3-phenylpropan-1-ol
IUPAC Name: (3S)-3-amino-3-phenylpropan-1-ol | CAS Registry Number: 82769-76-4
Synonyms: (3S)-3-amino-3-phenylpropan-1-ol, (s)-1-phenyl-3-propanolamine, AG-H-31124, (s)-beta-phenylalaninol, PubChem13854, AC1MC1BO, SureCN1454854, (s)-3-phenyl-beta-alaninol, KSC491Q5N, CTK3J1856, S-3-amino-3-phenylpropan-1-ol, MolPort-002-499-431, ACT03211, (s)-3-amino-3-phenyl propan-1-ol, (s)-3-amino-3-phenyl-propan-1-ol, AC-071, ANW-54196, AKOS015854099, (S)-3-AMINO-3-PHENYLPROPANOL, AG-H-31122

Molecular Formula: C9H13NOMolecular Weight: 151.205620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SEQXIQNPMQTBGN-VIFPVBQESA-N

• 2-Propoxybenzoic acid
IUPAC Name: 2-propoxybenzoate | CAS Registry Number: 2100-31-4
Synonyms: ZINC02572613, CID7021529

Molecular Formula: C10H11O3-Molecular Weight: 179.192540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OXOWWPXTTOCKKU-UHFFFAOYSA-M

• (L)-N-Boc-Pipecolic acid
IUPAC Name: (2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid | CAS Registry Number: 26250-84-0
Synonyms: Boc-Pip-OH, Boc-L-Pipecolic acid, N-Boc-L-pipecolinic acid, Oprea1_857311, 516368_ALDRICH, 15558_FLUKA, BL406-1, (S)-1-Boc-piperidine-2-carboxylic acid, TL8002097, (S)-(−)-1-(tert-Butoxycarbonyl)-2-piperidinecarboxylic acid

Molecular Formula: C11H19NO4Molecular Weight: 229.272860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JQAOHGMPAAWWQO-QMMMGPOBSA-N

• (S)-(+)-2-Methylpiperazine
IUPAC Name: (2S)-2-methylpiperazine | CAS Registry Number: 74879-18-8
Synonyms: (S)-2-Methylpiperazine, (2S)-2-methylpiperazine, S-MP, (S)-2-Methyl-Piperazine, AG-G-98021, PIPERAZINE, 2-METHYL-, (2S)-, s-2-methylpiperazine, PubChem9701, PubChem15035, 2-(s)-methylpiperazine, (S)-3-Methylpiperazine, AC1MC0MO, (-)-2-Methylpiperazine, SureCN16558, UNII-C5VI3S1YC0, s-(+)-2-methylpiperazine, AC1Q29PO, 2-Methylpiperazine, (S)-, S-(-)-2-Methylpiperazine, s-(+)-2-methyl piperazine

Molecular Formula: C5H12N2Molecular Weight: 100.162180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JOMNTHCQHJPVAZ-YFKPBYRVSA-N

• 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
IUPAC Name: 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine | CAS Registry Number: 329214-79-1
Synonyms: 576565_ALDRICH, BM077, 3-Pyridylboronic acid pinacol ester, 3-Pyridineboronic acid pinacol ester, Pyridine-3-boronic acid pinacol ester, ST5405620

Molecular Formula: C11H16BNO2Molecular Weight: 205.061240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XEMDFESAXKSEGI-UHFFFAOYSA-N

• 3,3',5-Triiodo-L-thyronine sodium salt
IUPAC Name: sodium (2S)-2-amino-3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]propanoate | CAS Registry Number: 55-06-1
Synonyms: Triostat, Cytomel, Tertroxin, Basoprocin, Ibiothyron, Cynomel, Cytomel sodium, Ro thyronine, triiodothyronine, T3 sodium salt, Sodium liothyronine, Sodium T3, LIOTHYRONINE SODIUM, Triiodothyronine sodium, Sodium triiodotironine, Triostat (TN), Sodium triiodothyronine, Cytomel (TN), Sodium-L-triiodothyronine, Liothyronine sodium salt

Molecular Formula: C15H11I3NNaO4Molecular Weight: 672.955320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: SBXXSUDPJJJJLC-YDALLXLXSA-M

• 2,6-Difluorobenzyl chloride
IUPAC Name: 2-(chloromethyl)-1,3-difluorobenzene | CAS Registry Number: 697-73-4
Synonyms: 559954_ALDRICH, 1-Chloromethyl-2,6-difluorobenzene, SBB005824, 2-(Chloromethyl)-1,3-difluorobenzene, D194, TL8004903

Molecular Formula: C7H5ClF2Molecular Weight: 162.564406 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MJXRENZUAQXZGJ-UHFFFAOYSA-N

• (S)-N-(tert-Butoxycarbonyl)valinol
IUPAC Name: tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate | CAS Registry Number: 79069-14-0
Synonyms: N-Boc-L-valinol, Boc-L-valinol, Boc-Valinol, N-(tert-Butoxycarbonyl)-L-valinol, AG-H-17044, (S)-2-(Boc-amino)-3-methyl-1-butanol, ST50825512, ZINC02572173, AC1ODVEA, PubChem15745, AC1Q1NPO, 444413_ALDRICH, 53254_FLUKA, CTK3J1845, MolPort-001-793-339, ACT04156, ANW-45725, FC1224, AKOS005259784, AKOS015907104

Molecular Formula: C10H21NO3Molecular Weight: 203.278640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: OOQRRYDVICNJGC-MRVPVSSYSA-N

• 3,4-Difluorobenzyl Alcohol
IUPAC Name: (3,4-difluorophenyl)methanol | CAS Registry Number: 85118-05-4
Synonyms: 3,4-Difluorobenzyl alcohol, (3,4-Difluorophenyl)methanol, Benzenemethanol, 3,4-difluoro-, 290297_ALDRICH, ZINC00164814, JRD-0386, EINECS 285-657-3, CID522833, BBV-142457

Molecular Formula: C7H6F2OMolecular Weight: 144.118746 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GNQLTCVBSGVGHC-UHFFFAOYSA-N

• 4-Butoxy-3-Nitrobenzoic Acid
IUPAC Name: 4-butoxy-3-nitrobenzoic acid | CAS Registry Number: 4906-28-9
Synonyms: 4-BUTOXY-3-NITROBENZOIC ACID, 4-butoxy-3-nitro-benzoic Acid, SureCN1749792, 4-Butoxy-3-nitrobenzoicacid, Benzoic acid,4-butoxy-3-nitro-, CTK4J1088, AKOS009146305, AG-F-65066, AK140634, KB-190176, A827650

Molecular Formula: C11H13NO5Molecular Weight: 239.224620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: WMMDYUIWNRMKKM-UHFFFAOYSA-N

• 4-Chloro-2-fluorobenzyl alcohol
IUPAC Name: (4-chloro-2-fluorophenyl)methanol | CAS Registry Number: 56456-49-6
Synonyms: MolPort-000-152-986, ZINC02512516, JRD-1487, CID2773609, BBV-5726008

Molecular Formula: C7H6ClFOMolecular Weight: 160.573343 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XUZRWKWJKDCQNA-UHFFFAOYSA-N

• 1-Heptane Sulphonic Acid Sodium Salt
IUPAC Name: sodium heptane-1-sulfonate | CAS Registry Number: 22767-50-6
Synonyms: Sodium heptane-1-sulphonate, SODIUM HEPTANE SULFONATE, 51832_FLUKA, 51833_FLUKA, 51835_FLUKA, CID89828, 1-Heptanesulfonic acid, sodium salt, EINECS 245-210-5, Sodium 1-heptanesulfonate monohydrate, 1-Heptanesulfonic acid sodium salt monohydrate

Molecular Formula: C7H15NaO3SMolecular Weight: 202.246970 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: REFMEZARFCPESH-UHFFFAOYSA-M

• 1-Pentane Sulphonic Acid Sodium Salt
IUPAC Name: sodium pentane-1-sulfonate | CAS Registry Number: 22767-49-3
Synonyms: 1-Pentanesulfonic acid, Sodium 1-pentanesulfonate, 1-Pentanesulfonic acid, sodium salt, EINECS 245-208-4, Sodium pentane-1-sulphonate monohydrate, 35452-30-3

Molecular Formula: C5H11NaO3SMolecular Weight: 174.193810 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ROBLTDOHDSGGDT-UHFFFAOYSA-M

• 4-(Trifluoromethoxy)benzyl alcohol
IUPAC Name: [4-(trifluoromethoxy)phenyl]methanol | CAS Registry Number: 1736-74-9
Synonyms: p-Trifluoromethoxybenzyl alcohol, 370614_ALDRICH, [4-(Trifluoromethoxy)phenyl]methanol, JRD-0281, CID137184, ZINC00167206, SDCCGMLS-0066270.P001, ST5405253, TL8001375

Molecular Formula: C8H7F3O2Molecular Weight: 192.135190 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: ZLSOZAOCYJDPKX-UHFFFAOYSA-N


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