Benzenoids
2-Indancarboxylic Acid 98.0+%, TCI America™
CAS: 25177-85-9 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00085095 InChI Key: XUDCMQBOWOLYCF-UHFFFAOYSA-N Synonym: 2-indancarboxylic acid,indane-2-carboxylic acid,indan-2-carboxylic acid,2-indanecarboxylic acid,1h-indene-2-carboxylic acid, 2,3-dihydro,chembl81558,2-carboxyindane,2-carboxy-indan,2-carboxy-indane,2-indancarboxylicacid PubChem CID: 575777 IUPAC Name: 2,3-dihydro-1H-indene-2-carboxylic acid SMILES: OC(=O)C1CC2=CC=CC=C2C1
Picene (purified by sublimation) (>99.9%) 99.9+%, TCI America™
CAS: 213-46-7 Molecular Formula: C22H14 Molecular Weight (g/mol): 278.354 MDL Number: MFCD00215857 InChI Key: GBROPGWFBFCKAG-UHFFFAOYSA-N Synonym: 3,4-benzchrysene,pycene,benzo a chrysene,1,2:7,8-dibenzophenanthrene,beta,beta-binaphthyleneethene,dibenzo a,i phenanthrene,1,2,7,8-dibenzphenanthrene,unii-f70r8zbr7t,f70r8zbr7t PubChem CID: 9162 ChEBI: CHEBI:33090 IUPAC Name: picene SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5=CC=CC=C54
Biphenyl-3-carboxylic Acid 98.0+%, TCI America™
CAS: 716-76-7 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.221 MDL Number: MFCD00045846 InChI Key: XNLWJFYYOIRPIO-UHFFFAOYSA-N Synonym: biphenyl-3-carboxylic acid,3-biphenylcarboxylic acid,1,1'-biphenyl-3-carboxylic acid,diphenyl-3-carboxylic acid,wln: qvr cr,3-biphenylcarboxylicacid,m-phenylbenzoic acid,3-phenyl benzoic acid PubChem CID: 12854 IUPAC Name: 3-phenylbenzoic acid SMILES: C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)O
1-Bromo-4-heptylbenzene (stabilized with Copper chip) 96.0+%, TCI America™
CAS: 76287-49-5 Molecular Formula: C13H19Br Molecular Weight (g/mol): 255.199 MDL Number: MFCD00061115 InChI Key: YHKMTIJHJWYYAG-UHFFFAOYSA-N Synonym: 1-bromo-4-n-heptylbenzene,1-4-bromophenyl heptane,4-heptylbromobenzene,benzene, 1-bromo-4-heptyl,4-bromo-1-heptylbenzene,1-bromo-4-heptyl-benzene,acmc-209p2u,1-bromanyl-4-heptyl-benzene,ksc912e9b PubChem CID: 2775100 IUPAC Name: 1-bromo-4-heptylbenzene SMILES: CCCCCCCC1=CC=C(C=C1)Br
(+/-)-Sulpiride 98.0+%, TCI America™
CAS: 15676-16-1 Molecular Formula: C15H23N3O4S Molecular Weight (g/mol): 341.43 MDL Number: MFCD00055061 InChI Key: BGRJTUBHPOOWDU-UHFFFAOYNA-N Synonym: sulpiride,sulpyrid,sulpirid,aiglonyl,dolmatil,dogmatil,guastil,mirbanil,misulvan,sursumid PubChem CID: 5355 ChEBI: CHEBI:32168 IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-sulfamoylbenzamide SMILES: CCN1CCCC1CNC(=O)C1=CC(=CC=C1OC)S(N)(=O)=O
5,6,7,8-Tetrahydro-1-naphthol 98.0+%, TCI America™
CAS: 529-35-1 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00001734 InChI Key: SCWNNOCLLOHZIG-UHFFFAOYSA-N Synonym: 5,6,7,8-tetrahydro-1-naphthol,5-hydroxytetralin,1-naphthalenol, 5,6,7,8-tetrahydro,tetralin-5-ol,5,6,7,8-tetrahydro-alpha-naphthol,unii-1r7b5i98hv,5,6,7,8-tetrahydronaphthol,5,6,7,8-tetrahydro-1-naphthalenol,5,6,7,8-tetrahydro-naphthalen-1-ol,tetrahydro-.alpha.-naphthol PubChem CID: 68258 ChEBI: CHEBI:45900 IUPAC Name: 5,6,7,8-tetrahydronaphthalen-1-ol SMILES: OC1=CC=CC2=C1CCCC2
Monoethyl 5-Nitroisophthalate 98.0+%, TCI America™
CAS: 22871-55-2 Molecular Formula: C10H9NO6 Molecular Weight (g/mol): 239.183 MDL Number: MFCD00130051 InChI Key: HOYHBDFTELAGGG-UHFFFAOYSA-N Synonym: 5-Nitroisophthalic Acid Monoethyl Ester PubChem CID: 89872 IUPAC Name: 3-ethoxycarbonyl-5-nitrobenzoic acid SMILES: CCOC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]
(2,4-Difluorophenyl)thiourea 98.0+%, TCI America™
CAS: 175277-76-6 Molecular Formula: C7H6F2N2S Molecular Weight (g/mol): 188.196 MDL Number: MFCD00041150 InChI Key: DZZSKQFBAGZNSH-UHFFFAOYSA-N Synonym: 2,4-difluorophenyl thiourea,1-2,4-difluorophenyl thiourea,1-2,4-difluorophenyl-2-thiourea,n-2,4-difluorophenyl thiourea,thiourea,n-2,4-difluorophenyl,amino 2,4-difluorophenyl amino methane-1-thione,acmc-1bxvl,buttpark 12118-31,difluorophenylthioacetonitrile,2,4-difluoro-phenyl-thiourea PubChem CID: 2734207 IUPAC Name: (2,4-difluorophenyl)thiourea SMILES: C1=CC(=C(C=C1F)F)NC(=S)N
2-Nitroisophthalic Acid 95.0+%, TCI America™
CAS: 21161-11-5 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.129 MDL Number: MFCD00017007 InChI Key: CAHWDGJDQYAFHM-UHFFFAOYSA-N PubChem CID: 88806 SMILES: C1=CC(=C(C(=C1)C(=O)O)[N+](=O)[O-])C(=O)O
2,4-Dibromoaniline 98.0+%, TCI America™
CAS: 615-57-6 Molecular Formula: C6H5Br2N Molecular Weight (g/mol): 250.921 MDL Number: MFCD00007633 InChI Key: DYSRXWYRUJCNFI-UHFFFAOYSA-N Synonym: benzenamine, 2,4-dibromo,2,4-dibromobenzenamine,2,4-dibromo-phenylamine,dibromobenzenamine,2,4-dibromanilin,pubchem3447,2,4-dibromophenylamine,benzenamine,4-dibromo,2,4-bis bromanyl aniline,acmc-209mu0 PubChem CID: 12004 IUPAC Name: 2,4-dibromoaniline SMILES: C1=CC(=C(C=C1Br)Br)N
4-Acetoxybenzaldehyde 98.0+%, TCI America™
CAS: 878-00-2 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00003384 InChI Key: SEVSMVUOKAMPDO-UHFFFAOYSA-N Synonym: 4-acetoxybenzaldehyde,p-acetoxybenzaldehyde,benzaldehyde, 4-acetyloxy,p-hydroxybenzaldehyde acetate,4-acetoxy benzaldehyde,4-formylphenyl acetate,4-acetyloxybenzaldehyde,acetic acid 4-formylphenyl ester,benzaldehyde, p-hydroxy-, acetate,benzaldehyde,4-acetyloxy PubChem CID: 70144 ChEBI: CHEBI:86559 IUPAC Name: (4-formylphenyl) acetate SMILES: CC(=O)OC1=CC=C(C=C1)C=O
2,4-Dibromoanisole 98.0+%, TCI America™
CAS: 21702-84-1 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.932 MDL Number: MFCD00000079 InChI Key: XGXUGXPKRBQINS-UHFFFAOYSA-N PubChem CID: 27011 IUPAC Name: 2,4-dibromo-1-methoxybenzene SMILES: COC1=C(C=C(C=C1)Br)Br
3,5-Dibromo-4-methylaniline 97.0+%, TCI America™
CAS: 13194-73-5 Molecular Formula: C7H7Br2N Molecular Weight (g/mol): 264.948 MDL Number: MFCD00151806 InChI Key: AQZDIKCNODUMNY-UHFFFAOYSA-N Synonym: 3,5-dibromo-p-toluidine,4-amino-2,6-dibromotoluene,benzenamine, 3,5-dibromo-4-methyl,acmc-1bt4r,ksc495c9l,3,5-dibrom-4-methyl-anilin,3,5-dibromo-4-methylphenylamine,3,5-dibromo-4-methylphenyl amine,benzenamine,3,5-dibromo-4-methyl,3,5-bis bromanyl-4-methyl-aniline PubChem CID: 7015779 IUPAC Name: 3,5-dibromo-4-methylaniline SMILES: CC1=C(C=C(C=C1Br)N)Br
2-Ethoxybenzoic Acid 98.0+%, TCI America™
CAS: 134-11-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002438 InChI Key: XDZMPRGFOOFSBL-UHFFFAOYSA-N Synonym: o-ethoxybenzoic acid,benzoic acid, 2-ethoxy,benzoic acid, o-ethoxy,o-ethylsalicylic acid,benzoic acid, ethoxy,2'-carboxyphenetole,2-ethoxy benzoic acid,2-ethoxy-benzoic acid,pubchem20122,ortho-ethoxybenzoic acid PubChem CID: 67252 IUPAC Name: 2-ethoxybenzoic acid SMILES: CCOC1=CC=CC=C1C(O)=O