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Frinton Laboratories, Inc


Contact: Dr. George Inglessis
Web: http://www.frinton.com
Address: 4204 Sylon Boulevard, Hainesport, New Jersey 08036, USA
Phone: +1-(856)-722-7037 | Fax: +1-(856)-439-1977 | Map/Directions >>

Profile: Frinton Laboratories, Inc. specializes in the field of organic chemistry. We produce organic compounds in quantities from a few grams to a few kilos. Our areas of specialization are aromatic intermediates and liquid crystals. We also offer squaric acid dibutyl ester, salicylaldazine, substituted benzoic acids, benzaldehydes, anilines and anisoles.

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• 4-(2-Bromoethoxy)phenol
IUPAC Name: 4-(2-bromoethoxy)phenol | CAS Registry Number: 31406-95-8
Synonyms: FR-2395

Molecular Formula: C8H9BrO2Molecular Weight: 217.059860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YKHKGUAWZWOFDH-UHFFFAOYSA-N

• 2,5-Dichloroterephthalic acid
IUPAC Name: 2,5-dichloroterephthalic acid | CAS Registry Number: 13799-90-1
Synonyms: Terephthalic acid, 2,5-dichloro-, NSC59392, EINECS 237-454-6, SBB008522, FR-2212, 1,4-Benzenedicarboxylic acid, 2,5-dichloro-, AI3-33425

Molecular Formula: C8H4Cl2O4Molecular Weight: 235.020960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LMOSYFZLPBHEOW-UHFFFAOYSA-N

• 3,4-Methylenedioxyacetophenone
IUPAC Name: 1-(1,3-benzodioxol-5-yl)ethanone | CAS Registry Number: 3162-29-6
Synonyms: 3',4'-(Methylenedioxy)acetophenone, MLS000515804, 274801_ALDRICH, NSC21866, EINECS 221-613-1, 1-(1,3-Benzodioxol-5-yl)ethanone, NSC 21866, SBB007858, ZINC00154661, FR-0469, 1-(1,3-Benzodioxol-5-yl)ethan-1-one, Ethanone, 1-(1,3-benzodioxol-5-yl)-, SMR000112277, AI3-30572

Molecular Formula: C9H8O3Molecular Weight: 164.158020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BMHMKWXYXFBWMI-UHFFFAOYSA-N

• 3-Fluoro-5-(trifluoromethyl)benzoic acid
IUPAC Name: 3-fluoro-5-(trifluoromethyl)benzoic acid | CAS Registry Number: 161622-05-5
Synonyms: Maybridge4_001933, 455326_ALDRICH, JRD-0140, NCGC00177103-01, ST5319730, TL80074079

Molecular Formula: C8H4F4O2Molecular Weight: 208.109773 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: NSGKIIGVPBTOBF-UHFFFAOYSA-N

• 3,3'-Diaminobenzophenone
IUPAC Name: bis(3-aminophenyl)methanone | CAS Registry Number: 611-79-0
Synonyms: CBMicro_014188, Oprea1_824643, Methanone, bis(3-aminophenyl)-, EINECS 210-281-3, NSC113058, ZINC00156685, FR-2387, BIM-0014348.P001, ST5409017, TL8003883, 5224-16-8

Molecular Formula: C13H12N2OMolecular Weight: 212.247180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: TUQQUUXMCKXGDI-UHFFFAOYSA-N

• 4-Nitrodiphenyl Sulfone
IUPAC Name: 1-(benzenesulfonyl)-4-nitrobenzene | CAS Registry Number: 1146-39-0
Synonyms: 4-Nitrodiphenylsulfone, 4-Nitrophenyl phenyl sulfone, p-Nitrophenyl phenyl sulfone, 1-Nitro-4-(phenylsulfonyl)benzene, AIDS019425, AIDS-019425, CID96708, NSC87340, ZINC00133179, Benzene, 1-nitro-4-(phenylsulfonyl)-, FR-0853, A1087/0051040

Molecular Formula: C12H9NO4SMolecular Weight: 263.269160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OECHJYYZMSUILG-UHFFFAOYSA-N

• 6-Nitro-3-(Phenylacetamido)Benzoic Acid
IUPAC Name: 2-nitro-5-[(2-phenylacetyl)amino]benzoic acid | CAS Registry Number: 52033-70-2
Synonyms: NIPAB, N8883_SIGMA, 6-Nitro-3-phenylacetamidobenzoic acid, CID193864, SBB008308, 2-Nitro-5-phenylacetaminobenzoic acid, FR-1204, 2-Nitro-5-phenylacetylamino-benzoic acid, 6-Nitro-3-(phenylacetamido)benzoic acid, 2-Nitro-5-[(phenylacetyl)amino]benzoic acid, Benzoic acid, 2-nitro-5-((phenylacetyl)amino)-

Molecular Formula: C15H12N2O5Molecular Weight: 300.266180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: QHVQEQRGDKOHHC-UHFFFAOYSA-N

• 1,4,4 A,8 A-Tetrahydro-Endo-1,4-Methanonaphthalene-5,8-Dione
Synonyms: Cyclopentadienebenzoquinone, NSC25329, NSC 25329, AIDS074041, AIDS-074041, CID79150, NSC196244, WLN: L C655 A DV GV EU JUTJ, LS-91070, 1,4,4a,8a-Tetrahydro-1,4-methanonaphthalene-5,8-dione, 1,4-Methanonaphthalene-5,8-dione, 1,4,4a,8a-tetrahydro-, 1,4,4-.alpha.,8-.alpha.-Tetrahydro-endo-1,4-methanonaphthalene-5,8-dione, (1RS,4SR,4aRS,8aSR)-1,4,4a,8a-tetrahydro[1,4-methanonaphtalen]-5,8-dione, 51175-59-8

Molecular Formula: C11H10O2Molecular Weight: 174.195900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FQLRTGXTYFCECH-UHFFFAOYSA-N

• 4,4'-Diaminobibenzyl
IUPAC Name: 4-[2-(4-aminophenyl)ethyl]aniline | CAS Registry Number: 621-95-4
Synonyms: 4,4'-Ethylenedianiline, 4,4'-Diaminodibenzyl, Aniline, 4,4'-ethylenedi-, 1,2-Bis(p-aminophenyl)ethane, 4,4'-Ethylenebis(aniline), alpha,alpha'-Bi-p-toluidine, CCRIS 1004, .alpha.,.alpha.'-Bi-p-toluidine, alpha, alpha-Bi-p-toluidine, Oprea1_504832, CBDivE_013839, MLS001180989, ANILINE, p,p'-ETHYLENEDI-, NSC 580, Benzenamine, 4,4'-(1,2-ethanediyl)bis-, NSC580, 1,2-Bis(4-Aminophenyl)ethane, 32784_FLUKA, EINECS 210-716-7, NSC 44062

Molecular Formula: C14H16N2Molecular Weight: 212.290240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UHNUHZHQLCGZDA-UHFFFAOYSA-N

• 4-Methyl-3-nitroanisole
IUPAC Name: 4-methoxy-1-methyl-2-nitrobenzene | CAS Registry Number: 17484-36-5
Synonyms: 3-Nitro-4-methylanisole, 4-Methoxy-2-nitrotoluene, Anisole, 4-methyl-3-nitro-, 139823_ALDRICH, 68008_FLUKA, ZINC02567949, CID87137, Benzene, 4-methoxy-1-methyl-2-nitro-, EINECS 241-500-0, SBB008488, FR-2165, ST5406610, TL8001387, InChI=1/C8H9NO3/c1-6-3-4-7(12-2)5-8(6)9(10)11/h3-5H,1-2H

Molecular Formula: C8H9NO3Molecular Weight: 167.161960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: JBORNNNGTJSTLC-UHFFFAOYSA-N

• 3'-Trifluoromethylpropionanilide
IUPAC Name: N-[3-(trifluoromethyl)phenyl]propanamide | CAS Registry Number: 2300-88-1
Synonyms: ZINC02168709, CID137536, N-[3-(Trifluoromethyl)phenyl]propanamide, FR-0902, VT-00358261

Molecular Formula: C10H10F3NOMolecular Weight: 217.187710 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RQXGETUNXUENJX-UHFFFAOYSA-N

• 3,5-Di-tert-butyl-4-hydroxybenzaldehyde
IUPAC Name: 3,5-ditert-butyl-4-hydroxybenzaldehyde | CAS Registry Number: 1620-98-0
Synonyms: 140406_ALDRICH, EINECS 216-592-0, NSC 14450, 3,5-Di-t-butyl-4-hydroxybenzaldehyde, NSC14450, BRN 0982526, SBB007996, ZINC00056443, Benzaldehyde, 3,5-di-tert-butyl-4-hydroxy-, FR-0717, 4-Hydroxy-3,5-di-tert-butylbenzaldehyde, Benzaldehyde, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, LS-24985, TL8001234, 4-08-00-00601 (Beilstein Handbook Reference), 3,5-Di-tert-butyl-4-hydroxybenzaldehyde hemihydrate, 2,6-Ditert-butyl-4-(hydroxymethylene)-2,5-cyclohexadien-1-one, Benzaldehyde, 3,5-bis(1,1-dimethylethyl)-4-hydroxy- (9CI), 2,3,5,6-Detetrahydrocyclohexanone, 2,6-di-t-butyl-4-hydroxymethylene-, InChI=1/C15H22O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-9,17H,1-6H

Molecular Formula: C15H22O2Molecular Weight: 234.333980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DOZRDZLFLOODMB-UHFFFAOYSA-N

• 1-bromo-2,3,5,6-Tetramethylbenzene
IUPAC Name: 3-bromo-1,2,4,5-tetramethylbenzene | CAS Registry Number: 1646-53-3
Synonyms: Bromodurene, 3-Bromodurene, 250104_ALDRICH, 1-Bromo-2,3,5,6-tetramethylbenzene, 3-Bromo-1,2,4,5-tetramethylbenzene, Benzene, 3-bromo-1,2,4,5-tetramethyl-, NSC87881, EINECS 216-707-4, SBB008221, ZINC01995246, FR-1079, AB-131/40897155, InChI=1/C10H13Br/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,1-4H

Molecular Formula: C10H13BrMolecular Weight: 213.114220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WJKBPTLQJXKEHC-UHFFFAOYSA-N

• 4'-n-Octylacetophenone
IUPAC Name: 1-(4-octylphenyl)ethanone | CAS Registry Number: 10541-56-7
Synonyms: p-Octylacetophenone, 4'-Octylacetophenone, p-n-Octylacetophenone, 4-n-Octylacetophenone, 4-Octylacetophenone, Acetophenone, 4'-octyl-, Ethanone, 1-(4-octylphenyl)-, NSC168987, SBB008323, FR-1228, NSC 168987

Molecular Formula: C16H24OMolecular Weight: 232.361160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GARQDIVXKVBJFP-UHFFFAOYSA-N

• 9,9-Bis(2-Cyanoethyl)Fluorene
IUPAC Name: 3-[9-(2-cyanoethyl)fluoren-9-yl]propanenitrile | CAS Registry Number: 4425-97-2
Synonyms: 9,9-Fluorenedipropionitrile, 9,9'-Fluorenedipropionitrile, Maybridge1_002232, 9,9-Bis(2-cyanoethyl)fluorene, Fluorene-9,9-bis(propionitrile), FLUORENE-9,9-DIPROPIONITRILE, 9H-Fluorene-9,9-dipropanenitrile, 9H-Fluorene-9,9-dipropiononitrile, NSC30667, EINECS 224-605-6, NSC 30667, BTB12648, CID20478, BRN 2622971, Propionitrile, 3,3'-fluoren-9-ylidenedi-, ZINC01661225, FR-0340, WLN: L B656 HHJ H2CN H2CN, 9H-Fluorene-9,9-dipropanenitrile (9CI), LS-69272

Molecular Formula: C19H16N2Molecular Weight: 272.343740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: COWHDUMHYFLLER-UHFFFAOYSA-N

• 4-Hydroxy-4'-Nitrostilbene
IUPAC Name: 4-[(E)-2-(4-nitrophenyl)ethenyl]phenol | CAS Registry Number: 14064-83-6
Synonyms: 4-Hydroxy-4'-nitrostilbene, CHEBI:448591, ZINC00225426, (trans)-4-(4-nitrostyryl)phenol, CID759250, 4-[(E)-2-(4-Nitrophenyl)ethenyl]phenol, FR-2032, Phenol, 4-[2-(4-nitrophenyl)ethenyl]-, LT03380654

Molecular Formula: C14H11NO3Molecular Weight: 241.242040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OETQWIHJPIESQB-OWOJBTEDSA-N

• 3-Methyltetrahydro
IUPAC Name: 4-methyl-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione | CAS Registry Number: 5333-84-6
Synonyms: 3-Methyltetrahydrophthalic anhydride, NSC2352, NSC 2352, NSC87811, EINECS 226-247-6, NSC154772, Maleic anhydride and 1,3-pentadiene adduct, 1,2,3,6-Tetrahydro-3-methylphthalic anhydride, 1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-4-methyl-, 3-Methyl-1,2,3,6-tetrahydrophthalic anhydride, 3-Methyl-4-cyclohexene-1,2-dicarboxylic anhydride, 3-Methyl-delta-4-tetrahydrophthalic anhydride, 3-Methyl-.delta.-4-tetrahydrophthalic anhydride, 4-Cyclohexene-1,2-dicarboxylic anhydride, 3-methyl-, 3-Methyl-.delta.(4)-tetrahydrophthalic anhydride, cis,cis-3-Methyl-4-cyclohexene-1,2-dicarboxylic acid anhydride, 35438-82-5

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XPEKVUUBSDFMDR-UHFFFAOYSA-N

• 4-Decyloxybenzaldehyde
IUPAC Name: 4-decoxybenzaldehyde | CAS Registry Number: 24083-16-7
Synonyms: p-Decyloxybenzaldehyde, 4-(Decyloxy)benzaldehyde, Benzaldehyde, 4-(decyloxy)-, CID141068, SBB008166, FR-0996, InChI=1/C17H26O2/c1-2-3-4-5-6-7-8-9-14-19-17-12-10-16(15-18)11-13-17/h10-13,15H,2-9,14H2,1H

Molecular Formula: C17H26O2Molecular Weight: 262.387140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WOSYBKJRUQJISL-UHFFFAOYSA-N

• 2,5-Dimethylbenzaldehyde
IUPAC Name: 2,5-dimethylbenzaldehyde | CAS Registry Number: 5779-94-2
Synonyms: Isoxylaldehyde, Benzaldehyde, 2,5-dimethyl-, 2,5-DIMETHYLBENZALDEHYDE, 151068_ALDRICH, EINECS 227-303-2, SBB008435, ZINC02012003, FR-2051, InChI=1/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H

Molecular Formula: C9H10OMolecular Weight: 134.175100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SMUVABOERCFKRW-UHFFFAOYSA-N

• 1,3-cyclopentanedione
IUPAC Name: cyclopentane-1,3-dione | CAS Registry Number: 3859-41-4
Synonyms: 1,3-Cyclopentanedione, 1,3-Cyclopentadione, Cyclopentane-1,3-dione, 1.3-CYCLOPENTANEDIONE, Maleimide-Related Compound 12, 177164_ALDRICH, CHEBI:41456, CID77466, EINECS 223-372-8, NSC364015, FR-2372, SL-00438, TL8002813, CEJ

Molecular Formula: C5H6O2Molecular Weight: 98.099940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LOGSONSNCYTHPS-UHFFFAOYSA-N

• 2,6-Naphthalenedicarboxylic acid
IUPAC Name: naphthalene-2,6-dicarboxylic acid | CAS Registry Number: 1141-38-4
Synonyms: 2,6-NAPHTHALIC ACID, naphthalene-2,6-dicarboxylic acid, 2,6-DICARBOXYNAPHTHALENE, EINECS 214-527-0, NSC 96410, SBB008377, SureCN18758, DSSTox_CID_9211, ACMC-2099kj, AC1Q73RL, DSSTox_RID_78711, NCIOpen2_007124, DSSTox_GSID_29211, 301353_ALDRICH, 523763_ALDRICH, AC1L23O7, Jsp001070, CHEBI:44460, CTK0H6341, MolPort-001-770-007

Molecular Formula: C12H8O4Molecular Weight: 216.189520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RXOHFPCZGPKIRD-UHFFFAOYSA-N

• 1,2-Dianilinoethane
IUPAC Name: N,N'-di(phenyl)ethane-1,2-diamine | CAS Registry Number: 150-61-8
Synonyms: Stabilite, NODX, N,N'-Ethylenedianiline, N,N'-Diphenylethylenediamine, sym-Diphenylethylenediamine, Aniline, N,N'-ethylenedi-, Maybridge1_002161, WLN: RM2MR, Ethylenediamine, N,N'-diphenyl-, 1,2-Ethanediamine, N,N'-diphenyl-, 2-anilino-ethyl-phenyl-amine, D27004_ALDRICH, N,N'-Diphenyl-1,2-ethylenediamine, N,N'-Difenylethylendiamin [Czech], NSC 8719, Wanzlick's Reagent for aldehydes, EINECS 205-765-6, Benzenamine, N,N'-1,2-ethanediylbis-, NSC8719, AIDS455201

Molecular Formula: C14H16N2Molecular Weight: 212.290240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NOUUUQMKVOUUNR-UHFFFAOYSA-N

• 4-Benzyloxy-3-methoxyacetophenone
IUPAC Name: 1-[3-methoxy-4-(phenylmethoxy)phenyl]ethanone | CAS Registry Number: 1835-11-6
Synonyms: 4'-Benzyloxy-3'-methoxyacetophenone, ZERO/004735, NSC201234, NSC 201234, CID99215, BRN 1885776, ZINC01735205, FR-1327, Acetophenone, 4'-(benzyloxy)-3'-methoxy-, LS-13384, 1-(3-Methoxy-4-(phenylmethoxy)phenyl)ethanone, 4-08-00-01817 (Beilstein Handbook Reference), Ethanone, 1-(3-methoxy-4-(phenylmethoxy)phenyl)-, Ethanone, 1-(3-methoxy-4-(phenylmethoxy)phenyl)- (9CI)

Molecular Formula: C16H16O3Molecular Weight: 256.296440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HRUAWSQBQLYDKH-UHFFFAOYSA-N

• 4-Sec-Butyl-2-(A-Methylbenzyl) Phenol
IUPAC Name: 4-butan-2-yl-2-(1-phenylethyl)phenol | CAS Registry Number: 2622-83-5
Synonyms: NSC97296, CID98293, EINECS 220-075-5, 4-sec-Butyl-2-(.alpha.-methylbenzyl)phenol, 4-sec-Butyl-2-(.alpha.-methylbenzyl)alcohol, 4-sec-Butyl-2-(alpha-methylbenzyl)phenol, 4-(1-Methylpropyl)-2-(1-phenylethyl)phenol, Phenol, 4-sec-butyl-2-(.alpha.-methylbenzyl)-, Phenol, 4-(1-methylpropyl)-2-(1-phenylethyl)-

Molecular Formula: C18H22OMolecular Weight: 254.366680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QJNBIFRUSFIANU-UHFFFAOYSA-N

• 4-Bromophthalic acid
IUPAC Name: 4-bromophthalic acid | CAS Registry Number: 6968-28-1
Synonyms: NSC20682, EINECS 230-183-4, 1,2-Benzenedicarboxylic acid, 4-bromo-, SBB007850, FR-0454

Molecular Formula: C8H5BrO4Molecular Weight: 245.026900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: AZXKGUVDIORSED-UHFFFAOYSA-N

• 2,6-Dichlorobenzaloxime
IUPAC Name: (NZ)-N-[(2,6-dichlorophenyl)methylidene]hydroxylamine | CAS Registry Number: 25185-95-9
Synonyms: ZINC00124443

Molecular Formula: C7H5Cl2NOMolecular Weight: 190.026700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBSXDWIAUZOFFV-WMZJFQQLSA-N

• 4-N-Pentylbenzaldehyde
IUPAC Name: 4-pentylbenzaldehyde | CAS Registry Number: 6853-57-2
Synonyms: p-Pentylbenzaldehyde, Benzaldehyde, 4-pentyl-, p-AMYLBENZALDEHYDE, 4-PENTYLBENZALDEHYDE, SBB008364, ZINC02029775, FR-1291

Molecular Formula: C12H16OMolecular Weight: 176.254840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NQVZPRUSNWNSQH-UHFFFAOYSA-N

• 2-Chloro-4-hydroxybenzoic acid hydrate
IUPAC Name: 2-chloro-4-hydroxybenzoic acid | CAS Registry Number: 56363-84-9
Synonyms: 2-Chloro-4-hydroxybenzoic acid, Benzoic acid, 2-chloro-4-hydroxy-, EINECS 260-132-1, SBB003833, FR-2358

Molecular Formula: C7H5ClO3Molecular Weight: 172.565800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WIPYZRZPNMUSER-UHFFFAOYSA-N

• 4-Chloro-3-Amino Benzotriflouride
IUPAC Name: 2-chloro-5-(trifluoromethyl)aniline | CAS Registry Number: 121-50-6
Synonyms: Orange Salt NRD, Fast Orange RD Oil, Fast Orange RD Salt, Fast Orange Salt RD, Daito Orange Salt RD, Diazo Fast Orange RD, Fast Orange Salt RDA, Fast Orange Salt RDN, 3-Amino-4-chlorobenzotrifluoride, Sanyo Fast Orange Salt RD, Azoene Fast Orange RD Salt, USAF MA-13, Hiltosal Fast Orange RD Salt, WLN: ZR BG EXFFF, 4-Chloro-3-aminobenzotrifluoride, 2-Chloro-5-(trifluoromethyl)aniline, CCRIS 2816, 07430_ALDRICH, 6-Chloro-3-(trifluoromethyl)aniline, Benzenamine, 2-chloro-5-(trifluoromethyl)-

Molecular Formula: C7H5ClF3NMolecular Weight: 195.569510 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VKTTYIXIDXWHKW-UHFFFAOYSA-N

• 4-N-Pentyloxybenzoic acid
IUPAC Name: 4-pentoxybenzoic acid | CAS Registry Number: 15872-41-0
Synonyms: 4-Pentyloxybenzoic acid, p-Pentyloxybenzoic acid, p-Pentoxybenzoic acid, 4-Pentoxybenzoic acid, p-n-Pentyloxybenzoic acid, p-(Pentyloxy)benzoic acid, 4-n-Pentyloxybenzoic acid, 4-(Pentyloxy)benzoic acid, Benzoic acid, 4-(pentyloxy)-, Benzoic acid, p-(pentyloxy)-, ARONIS009999, AIDS027808, AIDS-027808, ALBB-000944, NSC71397, NSC 71397, SBB007786, Benzoic acid, p-(pentyloxy)- (8CI), FR-0334, AI3-12067

Molecular Formula: C12H16O3Molecular Weight: 208.253640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OZPPUPJQRJYTNY-UHFFFAOYSA-N

• 9-Chloroanthracene
IUPAC Name: 9-chloroanthracene | CAS Registry Number: 716-53-0
Synonyms: Anthracene, 9-chloro-, CCRIS 5547, 252506_ALDRICH, EINECS 211-937-1, CID69744, FR-0493, LS-20283

Molecular Formula: C14H9ClMolecular Weight: 212.674260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KULLJOPUZUWTMF-UHFFFAOYSA-N

• 4-Tert-Butyl-O-Xylene
IUPAC Name: 4-tert-butyl-1,2-dimethylbenzene | CAS Registry Number: 7397-06-0
Synonyms: 4-t-Butyl-o-xylene, 4-tert-Butyl-o-xylene, 425141_ALDRICH, LTBB003601, CID81881, FR-0870, Benzene, 4-(1,1-dimethylethyl)-1,2-dimethyl-, InChI=1/C12H18/c1-9-6-7-11(8-10(9)2)12(3,4)5/h6-8H,1-5H

Molecular Formula: C12H18Molecular Weight: 162.271320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QRPPSTNABSMSCS-UHFFFAOYSA-N

• 1,3-Diphenyl-1-Butanone
IUPAC Name: 1,3-diphenylbutan-1-one | CAS Registry Number: 1533-20-6
Synonyms: 1,3-Diphenyl-1-butanone, 3-Phenylbutyrophenone, 1,3-diphenylbutan-1-one, NSC401995, CID137065, STK365606, DAH1579716, FR-0625, AH-357/03397006

Molecular Formula: C16H16OMolecular Weight: 224.297640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GIVFXLVPKFXTCU-UHFFFAOYSA-N

• 4'-(2-Methylpropyl)acetophenone
IUPAC Name: 1-[4-(2-methylpropyl)phenyl]ethanone | CAS Registry Number: 38861-78-8
Synonyms: 4-Isobutylacetophenone, p-iso-Butylacetophenone, p-Isobutylacetophenone, 4'-Isobutylacetophenone, Acetophenone, 4-isobutyl-, EINECS 254-159-8, NSC173015, SBB007668, ZINC01697860, FR-0079, NSC 173015, 1-(4-(2-Methylpropyl)phenyl)ethan-1-one, Ethanone, 1-(4-(2-methylpropyl)phenyl)-, Ethanone, 1-[4-(2-methylpropyl)phenyl]-, InChI=1/C12H16O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13/h4-7,9H,8H2,1-3H

Molecular Formula: C12H16OMolecular Weight: 176.254840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: KEAGRYYGYWZVPC-UHFFFAOYSA-N

• 4-Fluoro-3-nitrotoluene
IUPAC Name: 1-fluoro-4-methyl-2-nitrobenzene | CAS Registry Number: 446-11-7
Synonyms: 1-Fluoro-4-methyl-2-nitrobenzene, 4-Methyl-2-nitro-1-fluorobenzene, NSC93795, SBB008624, ZINC01609488, FR-2340, TL8003113

Molecular Formula: C7H6FNO2Molecular Weight: 155.126443 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OORBDHOQLZRIQR-UHFFFAOYSA-N

• 4-Amyloxybenzaldehyde
IUPAC Name: 4-pentoxybenzaldehyde | CAS Registry Number: 5736-91-4
Synonyms: 4-Pentoxybenzaldehyde, 4-Pentyloxybenzaldehyde, 4-(Pentyloxy)benzaldehyde, p-Amyloxy benzaldehyde, p-Pentyloxybenzaldehyde, p-(Pentyloxy)benzaldehyde, Benzaldehyde, 4-(pentyloxy)-, Benzaldehyde, p-(pentyloxy)-, ALBB-001162, NSC69105, EINECS 227-250-5, NSC 69105, SBB008032, ZINC01695467, FR-0786, AI3-05786

Molecular Formula: C12H16O2Molecular Weight: 192.254240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YAPVGSXODFOBBR-UHFFFAOYSA-N

• 2-Fluoro-5-iodobenzoic acid
IUPAC Name: 2-fluoro-5-iodobenzoic acid | CAS Registry Number: 124700-41-0
Synonyms: 2-Fluoro-5-iodobenzoicacid, Benzoic acid, 2-fluoro-5-iodo-, SBB051445, PubChem1385, AC1MCUDD, SureCN78403, ACMC-1C24W, KSC174O6D, 552437_ALDRICH, Jsp001621, RARECHEM AL BO 1479, CTK0H4761, MolPort-000-155-606, WT228, ACT12020, BUTTPARK 122\01-06, 5-IODO-2-FLUOROBENZOIC ACID, ANW-18273, AKOS005145857, AC-3964

Molecular Formula: C7H4FIO2Molecular Weight: 266.008333 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QNNJHBNTHVHALE-UHFFFAOYSA-N

• 1,5-Dibromo-2-pentyl acetate
IUPAC Name: 1,5-dibromopentan-2-yl acetate | CAS Registry Number: 205180-51-4
Synonyms: 2-Acetoxy-1,5-dibromopentane, 4-Bromo-1-(bromomethyl)butyl acetate, CID537552, SBB008125, FR-0914

Molecular Formula: C7H12Br2O2Molecular Weight: 287.976980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JGMIHIAAGUSENI-UHFFFAOYSA-N

• 2-Methyl-N-(3-trifluoromethylphenyl) propanamide
IUPAC Name: 2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide | CAS Registry Number: 1939-27-1
Synonyms: 3'-Trifluoromethylisobutyranilide, ZINC00282117, 3'-Trifluoromethyl-iso-butyranilide, CID137264, SBB008101, FR-0885, 2-Methyl-N-[3-(trifluoromethyl)phenyl]propanamide

Molecular Formula: C11H12F3NOMolecular Weight: 231.214290 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: GETMKVRSDFVVHL-UHFFFAOYSA-N

• 5-Chlorosalicylidene Aniline
IUPAC Name: (6Z)-6-(anilinomethylidene)-4-chlorocyclohexa-2,4-dien-1-one | CAS Registry Number: 15597-76-9
Synonyms: 5-Chlorosalicylidene aniline, ZINC02391024, CID5367160, FR-0811, 4-Chloro-2-[(E)-(phenylimino)methyl]phenol

Molecular Formula: C13H10ClNOMolecular Weight: 231.677600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ULMWQXHPFRTKOP-KTKRTIGZSA-N

• 2,6-Dihydroxy-P-Toluic Acid
IUPAC Name: 2,6-dihydroxy-4-methylbenzoic acid | CAS Registry Number: 480-67-1
Synonyms: p-Osellinic acid, p-Orsellinic acid, 4-Methyl-2,6-dihydroxybenzoic acid, gamma-Resorcylic acid, 4-methyl-, AIDS018064, AIDS-018064, CID68074, 2,6-dihydroxy-4-methylbenzoic acid, Benzoic acid, 2,6-dihydroxy-4-methyl-, SBB008572, FR-2276, LS-143445, AO-800/41069714

Molecular Formula: C8H8O4Molecular Weight: 168.146720 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: YBZAVRDNSPUMFK-UHFFFAOYSA-N

• 1,3-Bis(3-Aminophenoxy) Benzene
IUPAC Name: 3-[3-(3-aminophenoxy)phenoxy]aniline | CAS Registry Number: 10526-07-5
Synonyms: 1,3-Bis(3-aminophenoxy)benzene, 3,3'-(m-Phenylenedioxy)dianiline, EINECS 234-082-6, SBB008356, ZINC00057118, 3,3'-(m-Phenylenebis(oxy))dianiline, FR-1279, Benzenamine, 3,3'-[1,3-phenylenebis(oxy)]bis-, Benzenamine, 3,3'-(1,3-phenylenebis(oxy))bis-

Molecular Formula: C18H16N2O2Molecular Weight: 292.331840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: DKKYOQYISDAQER-UHFFFAOYSA-N

• 3-Penten-2-Ol
IUPAC Name: (E)-pent-3-en-2-ol | CAS Registry Number: 3899-34-1
Synonyms: 3-PENTEN-2-OL, trans-3-Penten-2-ol, Methyl propenyl carbinol, (3E)-3-Penten-2-ol, 3-Penten-2-ol (trans), 111287_ALDRICH, 77030_FLUKA, .alpha.,.gamma.-Dimethylallyl alcohol, 3-Penten-2-ol, predominantly trans, EINECS 216-376-6, ZINC02039433, CID5366239, FR-2138, AI3-28607, S14-1403, 1569-50-2, 42569-16-4

Molecular Formula: C5H10OMolecular Weight: 86.132300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GJYMQFMQRRNLCY-ONEGZZNKSA-N

• 2-Fluoro-4-hydroxybenzoic acid
IUPAC Name: 2-fluoro-4-hydroxybenzoic acid | CAS Registry Number: 65145-13-3
Synonyms: 2-Fluoro-4-hydroxybenzoic Acid, 2-fluoro-4-hydroxy-benzoic Acid, SBB051451, PubChem2608, AC1MD4FW, ACMC-1B9JP, SureCN311907, FRINTON FR-2445, KSC352Q5P, RARECHEM AL BO 0814, CTK2F2857, NXWTWYULZRDBSA-UHFFFAOYSA-, MolPort-001-778-504, Benzoicacid, 2-fluoro-4-hydroxy-, ACN-S003584, ACT00563, ANW-34991, AKOS005259825, AC-3958, AG-G-44935

Molecular Formula: C7H5FO3Molecular Weight: 156.111203 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NXWTWYULZRDBSA-UHFFFAOYSA-N

• 2-Amino-5-Methylbenzoic Acid
IUPAC Name: 2-amino-5-methylbenzoic acid | CAS Registry Number: 2941-78-8
Synonyms: 5-Methylanthranilic acid, 5-methylanthranilate, 2-Amino-5-methylbenzoic acid, 6-Amino-m-toluic acid, m-Toluic acid, 6-amino-, 5 - methylanthranilic acid, 419443_ALDRICH, 08403_FLUKA, Benzoic acid, 2-amino-5-methyl-, ALBB-006381, NSC39154, NSC50786, EINECS 220-932-3, CPD0-1488, SBB016389, FR-2396, InChI=1/C8H9NO2/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4H,9H2,1H3,(H,10,11

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NBUUUJWWOARGNW-UHFFFAOYSA-N

• 5-Methylisophthalic acid
IUPAC Name: 5-methylbenzene-1,3-dicarboxylic acid | CAS Registry Number: 499-49-0
Synonyms: UVITIC ACID, Isophthalic acid, 5-methyl-, 641383_ALDRICH, CID68137, NSC41436, EINECS 207-881-2, SBB008429, 1,3-Benzenedicarboxylic acid, 5-methyl-, 5-Methyl-1,3-benzenedicarboxylic acid, FR-2039

Molecular Formula: C9H8O4Molecular Weight: 180.157420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: PMZBHPUNQNKBOA-UHFFFAOYSA-N

• 5,5-Dimethyl-1,3-Dioxane
IUPAC Name: 5,5-dimethyl-1,3-dioxane | CAS Registry Number: 872-98-0
Synonyms: 5,5-Dimethyl-1,3-dioxane, 5,5-Dimethyl-m-dioxane, m-Dioxane, 5,5-dimethyl-, 1,3-Dioxane, 5,5-dimethyl-, EINECS 212-834-4, NSC139437, SBB008206, ZINC01845608, FR-1059

Molecular Formula: C6H12O2Molecular Weight: 116.158280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QDCJIPFNVBDLRH-UHFFFAOYSA-N

• 3-Chloro-N,N-Dimethylaniline
IUPAC Name: 3-chloro-N,N-dimethylaniline | CAS Registry Number: 6848-13-1
Synonyms: 3-Chloro-N,N-dimethylaniline, 3-Chloro-NN-dimethylaniline, N,N-Dimethyl-3-chloroaniline, M-CHLORO-N,N-DIMETHYLANILINE, ZINC00165746, CID23285, SEW05670, EINECS 229-935-4, Benzenamine, 3-chloro-N,N-dimethyl-, FR-1150

Molecular Formula: C8H10ClNMolecular Weight: 155.624700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CHHCCYVOJBBCIY-UHFFFAOYSA-N

• 2,3,5,6-Tetrahydroxy-1,4-Dinitrocyclohexane Dihydrate
IUPAC Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol | CAS Registry Number: 37098-43-4
Synonyms: NSC338240, CID322953, NSC281649

Molecular Formula: C6H10N2O8Molecular Weight: 238.152200 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: QGRCHCXTJJGBKG-UHFFFAOYSA-N

• 4-Chloro-A-(1-Methylethyl) Benzene Acetic Acid
IUPAC Name: 2-(4-chlorophenyl)-3-methylbutanoic acid | CAS Registry Number: 2012-74-0
Synonyms: Enamine_004948, 2-(p-Chlorophenyl)-3-methylbutyric acid, 537217_ALDRICH, 2-(4-Chlorophenyl)-3-methylbutyric acid, CHEBI:39345, EINECS 217-934-1, alpha-Isopropyl-p-chlorophenylacetic acid, CID16197, .alpha.-(p-Chlorophenyl)isovaleric acid, SBB008321, FR-1226, IDI1_007535, LS-47923, 2-(4-Chlorophenyl)-3-methylbutanoic acid, Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, BUTYRIC ACID, 2-(p-CHLOROPHENYL)-3-METHYL-, 55291-27-5

Molecular Formula: C11H13ClO2Molecular Weight: 212.672720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VTJMSIIXXKNIDJ-UHFFFAOYSA-N


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