Benzene and substituted derivatives
4-n-Decyloxybenzoic acid, 96%
CAS: 5519-23-3 Molecular Formula: C17H26O3 Molecular Weight (g/mol): 278.392 MDL Number: MFCD00020360 InChI Key: NZNICZRIRMGOFG-UHFFFAOYSA-N PubChem CID: 138527 IUPAC Name: 4-decoxybenzoic acid SMILES: CCCCCCCCCCOC1=CC=C(C=C1)C(=O)O
2,5-Dimethoxyphenylacetic acid, 99%
CAS: 1758-25-4 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00004322 InChI Key: BBZDYQUXRFATHZ-UHFFFAOYSA-N Synonym: 2,5-dimethoxyphenylacetic acid,2-2,5-dimethoxyphenyl acetic acid,2,5-dimethoxyphenyl acetic acid,benzeneacetic acid, 2,5-dimethoxy,acetic acid, 2,5-dimethoxyphenyl,2,5-dimethoxyphenyl-acetic acid,acmc-209eai,2,5-dimethoxyphenyl,rarechem al bo 0334,2,5-dimethoxy-phenethyl acid PubChem CID: 74469 IUPAC Name: 2-(2,5-dimethoxyphenyl)acetic acid SMILES: COC1=CC(=C(C=C1)OC)CC(=O)O
4-Allyl-2,6-dimethoxyphenol, 98%
CAS: 6627-88-9 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008655 InChI Key: FWMPKHMKIJDEMJ-UHFFFAOYSA-N Synonym: 4-allyl-2,6-dimethoxyphenol,methoxyeugenol,4-allylsyringol,phenol, 2,6-dimethoxy-4-2-propenyl,2,6-dimethoxychavicol,phenol, 4-allyl-2,6-dimethoxy,unii-8vf00ywp89,2,6-dimethoxy-4-allylphenol,2,6-dimethoxy-4-prop-2-en-1-yl phenol,4-hydroxy-3,5-dimethoxyallylbenzene PubChem CID: 226486 ChEBI: CHEBI:86562 IUPAC Name: 2,6-dimethoxy-4-prop-2-enylphenol SMILES: COC1=CC(CC=C)=CC(OC)=C1O
1,3-Diethoxybenzene, 95%
CAS: 2049-73-2 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00015145 InChI Key: MKGFYMKFBCWNCP-UHFFFAOYSA-N Synonym: m-diethoxybenzene,benzene, 1,3-diethoxy,resorcinol diethyl ether,resorcindiathylather,benzene,3-diethoxy,acmc-1cdp4,benzene, 1,3-diethoxy-9ci PubChem CID: 74899 IUPAC Name: 1,3-diethoxybenzene SMILES: CCOC1=CC(=CC=C1)OCC
3-Cyanobenzoic acid, 98+%
CAS: 1877-72-1 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00002486 InChI Key: GYLKKXHEIIFTJH-UHFFFAOYSA-N Synonym: m-cyanobenzoic acid,benzoic acid, 3-cyano,3-carboxybenzonitrile,3-cyano-benzoic acid,3-cyanobenzoicacid,benzoic acid, m-cyano,unii-d2gc692d78,3-cyano-benzoicacid,m-carboxybenzonitrile,3-cyano benzoic acid PubChem CID: 15875 IUPAC Name: 3-cyanobenzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C#N
3-Iodobenzaldehyde, 98%
CAS: 696-41-3 Molecular Formula: C7H5IO Molecular Weight (g/mol): 232.02 MDL Number: MFCD00039573 InChI Key: RZODAQZAFOBFLS-UHFFFAOYSA-N Synonym: 3-iodo-benzaldehyde,3-iodbenzaldehyd,benzaldehyde, 3-iodo,3-iodo benzaldehyde,3-iodanylbenzaldehyde,pubchem3917,acmc-1atsd,1-formyl-3-iodobenzene,m-iodobenzaldehyde,3-iodobenzaldehyde PubChem CID: 252610 IUPAC Name: 3-iodobenzaldehyde SMILES: C1=CC(=CC(=C1)I)C=O
2-Fluoro-5-iodobenzaldehyde, 97+%
CAS: 146137-76-0 Molecular Formula: C7H4FIO Molecular Weight (g/mol): 250.01 MDL Number: MFCD03093999 InChI Key: BIRCCQCPGMMGPJ-UHFFFAOYSA-N Synonym: 2-fluoro-5-iodo-benzaldehyde,pubchem4222,acmc-1bypb,c7h4flo,6-fluoro-3-iodobenzaldehyde,2-fluoranyl-5-iodanyl-benzaldehyde,2-fluoro-5-iodobenzaldehyde PubChem CID: 16217058 IUPAC Name: 2-fluoro-5-iodobenzaldehyde SMILES: FC1=C(C=O)C=C(I)C=C1
Pentafluorobenzaldehyde, 98%
CAS: 653-37-2 Molecular Formula: C7HF5O Molecular Weight (g/mol): 196.076 MDL Number: MFCD00003303 InChI Key: QJXCFMJTJYCLFG-UHFFFAOYSA-N Synonym: pentafluorobenzaldehyde,perfluorobenzaldehyde,benzaldehyde, pentafluoro,benzaldehyde, 2,3,4,5,6-pentafluoro,unii-s9yie3jz4k,pentafluor-benzaldehyd,s9yie3jz4k,pubchem4253,pentafluoro-benzaldehyde,acmc-209nqh PubChem CID: 69558 IUPAC Name: 2,3,4,5,6-pentafluorobenzaldehyde SMILES: C(=O)C1=C(C(=C(C(=C1F)F)F)F)F
o-Tolualdehyde, 98%, stab. with 0.1% hydroquinone
CAS: 529-20-4 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.151 MDL Number: MFCD00003338 InChI Key: BTFQKIATRPGRBS-UHFFFAOYSA-N Synonym: o-tolualdehyde,2-tolualdehyde,2-formyltoluene,o-toluylaldehyde,o-toluic aldehyde,o-tolylaldehyde,o-methylbenzaldehyde,benzaldehyde, 2-methyl,2-methyl-benzaldehyde,o-methylbenazldehyde PubChem CID: 10722 ChEBI: CHEBI:27434 IUPAC Name: 2-methylbenzaldehyde SMILES: CC1=CC=CC=C1C=O
3-Bromo-2,6-difluorobenzaldehyde, 98%
CAS: 398456-82-1 Molecular Formula: C7H3BrF2O Molecular Weight (g/mol): 221.001 MDL Number: MFCD08282773 InChI Key: OXBHKEYDKAWFLS-UHFFFAOYSA-N PubChem CID: 22139701 IUPAC Name: 3-bromo-2,6-difluorobenzaldehyde SMILES: C1=CC(=C(C(=C1F)C=O)F)Br
4-Cyanobenzaldehyde, 98%
CAS: 105-07-7 Molecular Formula: C8H5NO Molecular Weight (g/mol): 131.13 MDL Number: MFCD00003376 InChI Key: WZWIQYMTQZCSKI-UHFFFAOYSA-N Synonym: 4-cyanobenzaldehyde,benzonitrile, 4-formyl,p-cyanobenzaldehyde,p-formylbenzonitrile,benzaldehyde, p-cyano,benzonitrile, p-formyl,usaf kf-1,terephthalaldehydonitrile,p-cyanobenzenecarboxaldehyde,4-formyl-benzonitrile PubChem CID: 66042 IUPAC Name: 4-formylbenzonitrile SMILES: O=CC1=CC=C(C=C1)C#N
4-(1H-1,2,4-Triazol-1-yl)benzoic acid, 95%, Thermo Scientific™
CAS: 162848-16-0 Molecular Formula: C9H7N3O2 Molecular Weight (g/mol): 189.174 MDL Number: MFCD02682060 InChI Key: FOMQQGKCPYKKHQ-UHFFFAOYSA-N PubChem CID: 736531 IUPAC Name: 4-(1,2,4-triazol-1-yl)benzoic acid SMILES: C1=CC(=CC=C1C(=O)O)N2C=NC=N2
3-Phenoxypropionic acid, 98+%
CAS: 7170-38-9 Molecular Formula: C9H9O3 Molecular Weight (g/mol): 165.17 MDL Number: MFCD00002769 InChI Key: BUSOTUQRURCMCM-UHFFFAOYSA-M Synonym: 3-phenoxypropionic acid,propanoic acid, 3-phenoxy,beta-phenoxypropionic acid,3-penoxypropionic acid,3-phenoxy-propionic acid,3-phenoxypropionicacid,b-phenoxypropionate,3-phenoxypropionate,3-phenoxy-propanoate,beta-phenoxypropionate PubChem CID: 81596 IUPAC Name: 3-phenoxypropanoic acid SMILES: [O-]C(=O)CCOC1=CC=CC=C1
4-(1H-1,2,4-Triazol-1-ylmethyl)benzaldehyde 97+%, Thermo Scientific™
CAS: 859850-94-5 Molecular Formula: C10H9N3O Molecular Weight (g/mol): 187.202 InChI Key: XEPIORKIFKJATD-UHFFFAOYSA-N Synonym: 4-1h-1,2,4-triazol-1-ylmethyl benzaldehyde,4-1,2,4-triazol-1-ylmethyl benzaldehyde,4-1,2,4-triazolylmethyl benzaldehyde,4-1h-1,2,4-triazol-1-yl methyl benzaldehyde,benzaldehyde,4-1h-1,2,4-triazol-1-ylmethyl PubChem CID: 7164655 IUPAC Name: 4-(1,2,4-triazol-1-ylmethyl)benzaldehyde SMILES: C1=CC(=CC=C1CN2C=NC=N2)C=O
2,6-Dimethylbenzaldehyde, 97%
CAS: 1123-56-4 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00128003 InChI Key: QOJQBWSZHCKOLL-UHFFFAOYSA-N Synonym: m-xylene-2-carboxaldehyde,2,6-dimethyl-benzaldehyde,2-formyl-m-xylene,benzaldehyde, 2,6-dimethyl,2,6-dimethylbenzaldehyd,acmc-1bown,2,6-dimethyl benzaldehyde,ksc493s1p,pharmabridge p-2713,2,6-dimethylbenzaldehyde PubChem CID: 583841 IUPAC Name: 2,6-dimethylbenzaldehyde SMILES: CC1=C(C(=CC=C1)C)C=O