Benzenoids
1-Acetylnaphthalene, 97+%
CAS: 941-98-0 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.211 MDL Number: MFCD00004013 InChI Key: QQLIGMASAVJVON-UHFFFAOYSA-N Synonym: 1'-acetonaphthone,1-acetonaphthone,1-acetylnaphthalene,methyl 1-naphthyl ketone,1-acetonaphthalene,1-1-naphthalenyl ethanone,ethanone, 1-1-naphthalenyl,1-naphthalen-1-yl ethanone,1-naphthyl methyl ketone,alpha-acetonaphthone PubChem CID: 13663 IUPAC Name: 1-naphthalen-1-ylethanone SMILES: CC(=O)C1=CC=CC2=CC=CC=C21
6-Acetyl-2(3H)-benzothiazolone, 97%
CAS: 133044-44-7 Molecular Formula: C9H7NO2S Molecular Weight (g/mol): 193.22 MDL Number: MFCD02660572 InChI Key: UFRAIEFXNRTICG-UHFFFAOYSA-N Synonym: 6-acetyl-2 3h-benzothiazolone,6-acetylbenzo d thiazol-2 3h-one,1-2-hydroxybenzo d thiazol-6-yl ethanone,6-acetyl-1,3-benzothiazol-2 3h-one,2 3h-benzothiazolone,6-acetyl-9ci,pubchem21732,6-acetyl-3h-benzthiazole-2-one,6-acetyl-3h-benzothiazol-2-one,6-acetylbenzothiazol-2 3h-one,6-acetyl-2-benzothiazolone PubChem CID: 689053 IUPAC Name: 6-acetyl-3H-1,3-benzothiazol-2-one SMILES: CC(=O)C1=CC2=C(C=C1)NC(=O)S2
1-Acetyl-4-fluoronaphthalene, 97%
CAS: 316-68-7 Molecular Formula: C12H9FO Molecular Weight (g/mol): 188.201 MDL Number: MFCD00134475 InChI Key: GAMOBQXCYKWQLT-UHFFFAOYSA-N Synonym: 1-4-fluoronaphthalen-1-yl ethanone,1-acetyl-4-fluoronaphthalene,1-4-fluoro-1-naphthyl ethanone,4-fluoro-1-acetonaphthone,ethanone, 1-4-fluoro-1-naphthalenyl,1-4-fluoro-1-naphthyl ethan-1-one,4'-fluoro-1'-acetonaphthone,1-4-fluoronaphthalen-1-yl ethan-1-one,4-fluoroacetonaphthone,4'-fluoro-1'acetonaphthone PubChem CID: 67568 IUPAC Name: 1-(4-fluoronaphthalen-1-yl)ethanone SMILES: CC(=O)C1=CC=C(C2=CC=CC=C21)F
2-Acetylnaphthalene, 99%
CAS: 93-08-3 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.211 MDL Number: MFCD00004108 InChI Key: XSAYZAUNJMRRIR-UHFFFAOYSA-N Synonym: 2-acetylnaphthalene,2-acetonaphthone,2'-acetonaphthone,methyl 2-naphthyl ketone,acetonaphthone,1-naphthalen-2-yl ethanone,1-2-naphthyl ethanone,ethanone, 1-2-naphthalenyl,oranger cyrstals,2-naphthyl methyl ketone PubChem CID: 7122 ChEBI: CHEBI:52364 IUPAC Name: 1-naphthalen-2-ylethanone SMILES: CC(=O)C1=CC2=CC=CC=C2C=C1
p-Anisylchlorodiphenylmethane, 97%
CAS: 14470-28-1 Molecular Formula: C20H17ClO Molecular Weight (g/mol): 308.8 MDL Number: MFCD00000814 InChI Key: OBOHMJWDFPBPKD-UHFFFAOYSA-N Synonym: 4-methoxytriphenylchloromethane,4-methoxytrityl chloride,4-methoxytriphenylmethyl chloride,4-monomethoxytrityl chloride,mmtrcl,p-chlorodiphenylmethyl anisole,p-anisylchlorodiphenylmethane,1-chlorodiphenylmethyl-4-methoxybenzene,chloro 4-methoxyphenyl methylene dibenzene,4-methoxytritylchloride PubChem CID: 84462 IUPAC Name: 1-[chloro(diphenyl)methyl]-4-methoxybenzene SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Cl
3-(4-hydroxyphenyl)propanohydrazide, Thermo Scientific™
CAS: 65330-63-4 Molecular Formula: C9H12N2O2 Molecular Weight (g/mol): 180.21 MDL Number: MFCD00025134 InChI Key: JMNHUOPRGLTNJI-UHFFFAOYSA-N Synonym: 3-4-hydroxyphenyl propanohydrazide,3-4-hydroxyphenyl propanehydrazide,3-4-hydroxyphenyl propionohydrazide,benzenepropanoic acid,4-hydroxy-, hydrazide,benzenepropanoic acid, 4-hydroxy-, hydrazide PubChem CID: 2796587 IUPAC Name: 3-(4-hydroxyphenyl)propanehydrazide SMILES: NNC(=O)CCC1=CC=C(O)C=C1
4-Hydroxyphthalic acid, 98%
CAS: 610-35-5 Molecular Formula: C8H6O5 Molecular Weight (g/mol): 182.13 InChI Key: MWRVRCAFWBBXTL-UHFFFAOYSA-N Synonym: 1,2-benzenedicarboxylic acid, 4-hydroxy,4-hydroxybenzene-1,2-dicarboxylic acid,4-hydroxy-1,2-benzenedicarboxylic acid,3,4-dicarboxyphenol,4-hydroxy-phthalic acid,acmc-1avol,ksc357m7h,4-hydroxyphthalic acid,4-hydroxy-1,2-benzenedicarboxylicacid,1,2-benzenedicarboxylicacid, 4-hydroxy PubChem CID: 11881 ChEBI: CHEBI:27600 IUPAC Name: 4-hydroxyphthalic acid SMILES: C1=CC(=C(C=C1O)C(=O)O)C(=O)O
4-Hydroxybenzeneboronic acid, 97%
CAS: 71597-85-8 Molecular Formula: C6H7BO3 Molecular Weight (g/mol): 137.93 MDL Number: MFCD01074628 InChI Key: COIQUVGFTILYGA-UHFFFAOYSA-N Synonym: 4-hydroxyphenyl boronic acid,4-hydroxybenzeneboronic acid,4-boronophenol,4-hydroxyphenyl boranediol,p-hydroxyphenylboronic acid,4-hydroxyphenyl-boronic acid,boronic acid, 4-hydroxyphenyl,pubchem1729,acmc-209ojb PubChem CID: 2734360 IUPAC Name: (4-hydroxyphenyl)boronic acid SMILES: OB(O)C1=CC=C(O)C=C1
4-Hydroxy-3-nitrophenylacetic acid, 99%, Thermo Scientific™
CAS: 10463-20-4 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.15 InChI Key: QBHBHOSRLDPIHG-UHFFFAOYSA-N Synonym: 4-hydroxy-3-nitrophenylacetic acid,2-4-hydroxy-3-nitrophenyl acetic acid,4-hydroxy-3-nitrophenyl acetic acid,3-nitro-4-hydroxyphenylacetic acid,3-nitro-4-hydroxy phenylacetic acid,benzeneacetic acid, 4-hydroxy-3-nitro,no2hpa,hydroxynitrophenylaceticacid,acmc-2098cj,epitope id:158629 PubChem CID: 447364 ChEBI: CHEBI:546274 SMILES: C1=CC(=C(C=C1CC(=O)O)[N+](=O)[O-])O
7-Hydroxyisoquinoline, 97%, Thermo Scientific Chemicals
CAS: 7651-83-4 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00456131 InChI Key: WCRKBMABEPCYII-UHFFFAOYSA-N Synonym: 7-hydroxyisoquinoline,7-isoquinolinol,7-hydroxy-isoquinoline,isoquinolin-7-ol, 7-hydroxy-2-azanaphthalene,pubchem6264,acmc-1bfxl,ksc380o3r,7-hydroxyisoquinoline 250mg PubChem CID: 459767 IUPAC Name: isoquinolin-7-ol SMILES: OC1=CC=C2C=CN=CC2=C1
4-(1,3-Dithiolan-2-yl)phenol, 97%
CAS: 22068-49-1 Molecular Formula: C9H10OS2 Molecular Weight (g/mol): 198.30 MDL Number: MFCD00068127 InChI Key: LTNPCGWCUVDEEY-UHFFFAOYSA-N Synonym: 4-1,3-dithiolan-2-yl phenol,unii-pip8o1r36t,pip8o1r36t,p-1,3-dithiolan-2-yl phenol,phenol, p-1,3-dithiolan-2-yl,2-4-hydroxyphenyl-1,3-dithiolane,2-4'-hydroxyphenyl-1,3-dithiolane,1,3-dithiolane, 2-4-hydroxyphenyl,acmc-1cmgs,phenol,4-1,3-dithiolan-2-yl PubChem CID: 97562 IUPAC Name: 4-(1,3-dithiolan-2-yl)phenol SMILES: OC1=CC=C(C=C1)C1SCCS1
1-Bromo-4-(ethylthio)benzene, 97%
CAS: 30506-30-0 Molecular Formula: C8H9BrS Molecular Weight (g/mol): 217.124 MDL Number: MFCD01318109 InChI Key: CTFHVAKXUMMGOC-UHFFFAOYSA-N Synonym: 1-bromo-4-ethylthio benzene,1-bromo-4-ethylsulfanyl benzene,4-bromophenyl ethyl sulfane,benzene,1-bromo-4-ethylthio,acmc-1ae1n,1-bromo-4-ethylthiobenzene,4-bromo-1-ethylthiobenzene,ethyl 4-bromophenyl sulfide,1-bromo-4-ethylthio-benzene,1-bromo-4-ethylsulfanyl-benzene PubChem CID: 7006650 IUPAC Name: 1-bromo-4-ethylsulfanylbenzene SMILES: CCSC1=CC=C(C=C1)Br
4-Bromo-3-chlorophenol, 98%, Thermo Scientific Chemicals
CAS: 13631-21-5 Molecular Formula: C6H4BrClO Molecular Weight (g/mol): 207.451 MDL Number: MFCD00070744 InChI Key: FQEYHIPPYOSPLF-UHFFFAOYSA-N Synonym: phenol, 4-bromo-3-chloro,3-chloro-4-bromophenol,2-chloro-4-hydroxybromobenzene,pubchem3597,acmc-1bvpq,4-bromo-3-chloro-phenol,intermediates-zcf02051,ksc493i5n,4-bromanyl-3-chloranyl-phenol PubChem CID: 7018182 IUPAC Name: 4-bromo-3-chlorophenol SMILES: C1=CC(=C(C=C1O)Cl)Br
1,3,5-Tri-tert-butylbenzene, 97+%
CAS: 1460-02-2 Molecular Formula: C18H30 Molecular Weight (g/mol): 246.438 MDL Number: MFCD00008831 InChI Key: GUFMBISUSZUUCB-UHFFFAOYSA-N Synonym: 1,3,5-tri-tert-butylbenzene,benzene, 1,3,5-tris 1,1-dimethylethyl,1,3,5-tri-t-butylbenzene,benzene, 1,3,5-tri-tert-butyl,1,3,5-tris tert-butyl benzene,pubchem13719,intermediates-zcf02115,acmc-209cw6,2,4,6-tri-tert-butylphenyl,ksc490m7l PubChem CID: 15089 IUPAC Name: 1,3,5-tritert-butylbenzene SMILES: CC(C)(C)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C
2-(4-Benzyloxyphenyl)ethanol, 98+%
CAS: 61439-59-6 Molecular Formula: C15H16O2 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00017532 InChI Key: JCUJAHLWCDISCC-UHFFFAOYSA-N Synonym: 2-4-benzyloxyphenyl ethanol,2-4-benzyloxy phenyl ethanol,p-benzyloxy phenethyl alcohol,4-benzyloxyphenylethyl alcohol,4-benzyloxyphenethyl alcohol,4-benzyloxy phenethylalcohol,benzeneethanol, 4-phenylmethoxy,2-p-benzyloxyphenyl ethanol,4-benzyloxy phenethyl alcohol PubChem CID: 3017260 IUPAC Name: 2-(4-phenylmethoxyphenyl)ethanol SMILES: OCCC1=CC=C(OCC2=CC=CC=C2)C=C1