Benzenoids
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3-(2-Methyl-thiazol-4-yl)-benzaldehyde, 97%, Thermo Scientific™
CAS: 850375-05-2 Molecular Formula: C11H9NOS Molecular Weight (g/mol): 203.26 MDL Number: MFCD02681946 InChI Key: FQQPVEKQPGDYPD-UHFFFAOYSA-N PubChem CID: 7127782 IUPAC Name: 3-(2-methyl-1,3-thiazol-4-yl)benzaldehyde SMILES: CC1=NC(=CS1)C1=CC(C=O)=CC=C1
| PubChem CID | 7127782 |
|---|---|
| CAS | 850375-05-2 |
| Molecular Weight (g/mol) | 203.26 |
| MDL Number | MFCD02681946 |
| SMILES | CC1=NC(=CS1)C1=CC(C=O)=CC=C1 |
| IUPAC Name | 3-(2-methyl-1,3-thiazol-4-yl)benzaldehyde |
| InChI Key | FQQPVEKQPGDYPD-UHFFFAOYSA-N |
| Molecular Formula | C11H9NOS |
m-Anisaldehyde, 97%
CAS: 591-31-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 InChI Key: WMPDAIZRQDCGFH-UHFFFAOYSA-N Synonym: m-anisaldehyde,3-anisaldehyde,benzaldehyde, 3-methoxy,m-methoxybenzaldehyde,metamethoxybenzaldehyde,3-methoxy-benzaldehyde,unii-8zao7s0ivh,ccris 960,meta-anisaldehyde,8zao7s0ivh PubChem CID: 11569 IUPAC Name: 3-methoxybenzaldehyde SMILES: COC1=CC=CC(=C1)C=O
| PubChem CID | 11569 |
|---|---|
| CAS | 591-31-1 |
| Molecular Weight (g/mol) | 136.15 |
| SMILES | COC1=CC=CC(=C1)C=O |
| Synonym | m-anisaldehyde,3-anisaldehyde,benzaldehyde, 3-methoxy,m-methoxybenzaldehyde,metamethoxybenzaldehyde,3-methoxy-benzaldehyde,unii-8zao7s0ivh,ccris 960,meta-anisaldehyde,8zao7s0ivh |
| IUPAC Name | 3-methoxybenzaldehyde |
| InChI Key | WMPDAIZRQDCGFH-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
2-Chloro-4-bromo-5-fluorobenzaldehyde, 98%
CAS: 1214386-29-4 Molecular Formula: C7H3BrClFO Molecular Weight (g/mol): 237.452 MDL Number: MFCD13185877 InChI Key: XPEGZWLIWARWAA-UHFFFAOYSA-N Synonym: 2-chloro-4-bromo-5-fluorobenzaldehyde PubChem CID: 70680695 IUPAC Name: 4-bromo-2-chloro-5-fluorobenzaldehyde SMILES: C1=C(C(=CC(=C1F)Br)Cl)C=O
| PubChem CID | 70680695 |
|---|---|
| CAS | 1214386-29-4 |
| Molecular Weight (g/mol) | 237.452 |
| MDL Number | MFCD13185877 |
| SMILES | C1=C(C(=CC(=C1F)Br)Cl)C=O |
| Synonym | 2-chloro-4-bromo-5-fluorobenzaldehyde |
| IUPAC Name | 4-bromo-2-chloro-5-fluorobenzaldehyde |
| InChI Key | XPEGZWLIWARWAA-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrClFO |
m-Anisaldehyde, Spectrum™ Chemical
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CAS: 591-31-1
| CAS | 591-31-1 |
|---|
Benzoyl isothiocyanate, 98%
CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.194 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S
| PubChem CID | 68284 |
|---|---|
| CAS | 532-55-8 |
| Molecular Weight (g/mol) | 163.194 |
| MDL Number | MFCD00004815 |
| SMILES | C1=CC=C(C=C1)C(=O)N=C=S |
| Synonym | benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone |
| IUPAC Name | benzoyl isothiocyanate |
| InChI Key | CPEKAXYCDKETEN-UHFFFAOYSA-N |
| Molecular Formula | C8H5NOS |
o-Tolualdehyde, 98%, stabilized
CAS: 529-20-4 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.15 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
| PubChem CID | 10722 |
|---|---|
| CAS | 529-20-4 |
| Molecular Weight (g/mol) | 120.15 |
| ChEBI | CHEBI:27434 |
| MDL Number | MFCD00003338 |
| SMILES | CC1=CC=CC=C1C=O |
| Synonym | o-tolualdehyde,2-tolualdehyde,2-formyltoluene,o-toluylaldehyde,o-toluic aldehyde,o-tolylaldehyde,o-methylbenzaldehyde,benzaldehyde, 2-methyl,2-methyl-benzaldehyde,o-methylbenazldehyde |
| IUPAC Name | 2-methylbenzaldehyde |
| InChI Key | BTFQKIATRPGRBS-UHFFFAOYSA-N |
| Molecular Formula | C8H8O |
2-Ethylbenzaldehyde, 97%
CAS: 22927-13-5 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD02261766 InChI Key: NTWBHJYRDKBGBR-UHFFFAOYSA-N Synonym: benzaldehyde, 2-ethyl,o-ethylbenzaldehyde,2-ethyl benzaldehyde,2-ethyl-benzaldehyde,ethylbenzaldehyde,2-ethyl-benzaldehyd,6-ethyl benzaldehyde,pubchem3074,acmc-20a49p PubChem CID: 123406 IUPAC Name: 2-ethylbenzaldehyde SMILES: CCC1=CC=CC=C1C=O
| PubChem CID | 123406 |
|---|---|
| CAS | 22927-13-5 |
| Molecular Weight (g/mol) | 134.18 |
| MDL Number | MFCD02261766 |
| SMILES | CCC1=CC=CC=C1C=O |
| Synonym | benzaldehyde, 2-ethyl,o-ethylbenzaldehyde,2-ethyl benzaldehyde,2-ethyl-benzaldehyde,ethylbenzaldehyde,2-ethyl-benzaldehyd,6-ethyl benzaldehyde,pubchem3074,acmc-20a49p |
| IUPAC Name | 2-ethylbenzaldehyde |
| InChI Key | NTWBHJYRDKBGBR-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
3-Formylphenylboronic acid, 97%
CAS: 87199-16-4 Molecular Formula: C7H7BO3 Molecular Weight (g/mol): 149.94 MDL Number: MFCD00161356 InChI Key: HJBGZJMKTOMQRR-UHFFFAOYSA-N Synonym: 3-formylphenyl boronic acid,3-formylbenzeneboronic acid,3-boronobenzaldehyde,3-formyl phenylboronic acid,3-formylboronic acid,m-formylphenylboronic acid,3-dihydroxyboryl benzaldehyde,boronic acid, 3-formylphenyl,3-formylphenylboronicacid PubChem CID: 2734356 IUPAC Name: (3-formylphenyl)boronic acid SMILES: OB(O)C1=CC=CC(C=O)=C1
| PubChem CID | 2734356 |
|---|---|
| CAS | 87199-16-4 |
| Molecular Weight (g/mol) | 149.94 |
| MDL Number | MFCD00161356 |
| SMILES | OB(O)C1=CC=CC(C=O)=C1 |
| Synonym | 3-formylphenyl boronic acid,3-formylbenzeneboronic acid,3-boronobenzaldehyde,3-formyl phenylboronic acid,3-formylboronic acid,m-formylphenylboronic acid,3-dihydroxyboryl benzaldehyde,boronic acid, 3-formylphenyl,3-formylphenylboronicacid |
| IUPAC Name | (3-formylphenyl)boronic acid |
| InChI Key | HJBGZJMKTOMQRR-UHFFFAOYSA-N |
| Molecular Formula | C7H7BO3 |
Dicyclohexyl phthalate, 99%
CAS: 84-61-7 Molecular Formula: C20H26O4 Molecular Weight (g/mol): 330.42 MDL Number: MFCD00003849 InChI Key: VOWAEIGWURALJQ-UHFFFAOYSA-N Synonym: dicyclohexyl phthalate,ergoplast fdc,unimoll 66,ergoplast.fdc,howflex cp,phthalic acid, dicyclohexyl ester,phthalic acid dicyclohexyl ester,1,2-benzenedicarboxylic acid, dicyclohexyl ester,unii-cgd15m7h2n,ccris 6190 PubChem CID: 6777 ChEBI: CHEBI:34693 IUPAC Name: dicyclohexyl benzene-1,2-dicarboxylate SMILES: C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3
| PubChem CID | 6777 |
|---|---|
| CAS | 84-61-7 |
| Molecular Weight (g/mol) | 330.42 |
| ChEBI | CHEBI:34693 |
| MDL Number | MFCD00003849 |
| SMILES | C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3 |
| Synonym | dicyclohexyl phthalate,ergoplast fdc,unimoll 66,ergoplast.fdc,howflex cp,phthalic acid, dicyclohexyl ester,phthalic acid dicyclohexyl ester,1,2-benzenedicarboxylic acid, dicyclohexyl ester,unii-cgd15m7h2n,ccris 6190 |
| IUPAC Name | dicyclohexyl benzene-1,2-dicarboxylate |
| InChI Key | VOWAEIGWURALJQ-UHFFFAOYSA-N |
| Molecular Formula | C20H26O4 |
4-Ethylbenzoic acid, 97%
CAS: 619-64-7 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00002570 InChI Key: ZQVKTHRQIXSMGY-UHFFFAOYSA-N Synonym: benzoic acid, 4-ethyl,p-ethylbenzoic acid,4-ethyl benzoic acid,4-ethyl-benzoic acid,unii-9tkm8p0g6r,9tkm8p0g6r,p-ethylbenzoate,4-ethyl benzoate,4-ethylbenzoicacid,p-ethylbenzoic acid; PubChem CID: 12086 IUPAC Name: 4-ethylbenzoic acid SMILES: CCC1=CC=C(C=C1)C(=O)O
| PubChem CID | 12086 |
|---|---|
| CAS | 619-64-7 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00002570 |
| SMILES | CCC1=CC=C(C=C1)C(=O)O |
| Synonym | benzoic acid, 4-ethyl,p-ethylbenzoic acid,4-ethyl benzoic acid,4-ethyl-benzoic acid,unii-9tkm8p0g6r,9tkm8p0g6r,p-ethylbenzoate,4-ethyl benzoate,4-ethylbenzoicacid,p-ethylbenzoic acid; |
| IUPAC Name | 4-ethylbenzoic acid |
| InChI Key | ZQVKTHRQIXSMGY-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
3-Fluorobenzaldehyde, 98+%
CAS: 456-48-4 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.11 MDL Number: MFCD00003348 InChI Key: PIKNVEVCWAAOMJ-UHFFFAOYSA-N Synonym: m-fluorobenzaldehyde,benzaldehyde, 3-fluoro,3'-fluoro-benzaldehyde,3-fluoro-benzaldehyde,meta-fluorobenzaldehyde,benzaldehyde, m-fluoro,3-fc6h4cho,3-fluorobenzaldehyde,3-fluoro benzaldehyde,pubchem3477 PubChem CID: 68009 IUPAC Name: 3-fluorobenzaldehyde SMILES: C1=CC(=CC(=C1)F)C=O
| PubChem CID | 68009 |
|---|---|
| CAS | 456-48-4 |
| Molecular Weight (g/mol) | 124.11 |
| MDL Number | MFCD00003348 |
| SMILES | C1=CC(=CC(=C1)F)C=O |
| Synonym | m-fluorobenzaldehyde,benzaldehyde, 3-fluoro,3'-fluoro-benzaldehyde,3-fluoro-benzaldehyde,meta-fluorobenzaldehyde,benzaldehyde, m-fluoro,3-fc6h4cho,3-fluorobenzaldehyde,3-fluoro benzaldehyde,pubchem3477 |
| IUPAC Name | 3-fluorobenzaldehyde |
| InChI Key | PIKNVEVCWAAOMJ-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO |
2-Chloro-4-(dimethylamino)benzaldehyde, ≥95%, Thermo Scientific™
CAS: 1424-66-4 Molecular Formula: C9H10ClNO Molecular Weight (g/mol): 183.64 MDL Number: MFCD00021051 InChI Key: XSQFAWMDRFSIMY-UHFFFAOYSA-N Synonym: 2-chloro-4-dimethylamino benzaldehyde,benzaldehyde, 2-chloro-4-dimethylamino,benzaldehyde,2-chloro-4-dimethylamino,2-chloro-4-n,n-bis methyl amino benzaldehyde,4-dimethylamino-2-chlorobenzaldehyde,acmc-209coh,3-chloro-n,n-dimethyl-4-formylaniline PubChem CID: 74021 IUPAC Name: 2-chloro-4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C(Cl)=C1
| PubChem CID | 74021 |
|---|---|
| CAS | 1424-66-4 |
| Molecular Weight (g/mol) | 183.64 |
| MDL Number | MFCD00021051 |
| SMILES | CN(C)C1=CC=C(C=O)C(Cl)=C1 |
| Synonym | 2-chloro-4-dimethylamino benzaldehyde,benzaldehyde, 2-chloro-4-dimethylamino,benzaldehyde,2-chloro-4-dimethylamino,2-chloro-4-n,n-bis methyl amino benzaldehyde,4-dimethylamino-2-chlorobenzaldehyde,acmc-209coh,3-chloro-n,n-dimethyl-4-formylaniline |
| IUPAC Name | 2-chloro-4-(dimethylamino)benzaldehyde |
| InChI Key | XSQFAWMDRFSIMY-UHFFFAOYSA-N |
| Molecular Formula | C9H10ClNO |
4'-Methylbiphenyl-4-carboxylic acid, 96%
CAS: 720-73-0 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.248 MDL Number: MFCD00448778 InChI Key: RZOCCLOTCXINRG-UHFFFAOYSA-N Synonym: 4'-methylbiphenyl-4-carboxylic acid,4-4-methylphenyl benzoic acid,4'-methyl-1,1'-biphenyl-4-carboxylic acid,4'-methyl 1,1'-biphenyl-4-carboxylic acid,4'-methyl-4-biphenylcarboxylic acid,4'-methyl-biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylicacid, 4'-methyl,1,1'-biphenyl-4-carboxylic acid, 4'-methyl PubChem CID: 2063421 IUPAC Name: 4-(4-methylphenyl)benzoic acid SMILES: CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 2063421 |
|---|---|
| CAS | 720-73-0 |
| Molecular Weight (g/mol) | 212.248 |
| MDL Number | MFCD00448778 |
| SMILES | CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O |
| Synonym | 4'-methylbiphenyl-4-carboxylic acid,4-4-methylphenyl benzoic acid,4'-methyl-1,1'-biphenyl-4-carboxylic acid,4'-methyl 1,1'-biphenyl-4-carboxylic acid,4'-methyl-4-biphenylcarboxylic acid,4'-methyl-biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylicacid, 4'-methyl,1,1'-biphenyl-4-carboxylic acid, 4'-methyl |
| IUPAC Name | 4-(4-methylphenyl)benzoic acid |
| InChI Key | RZOCCLOTCXINRG-UHFFFAOYSA-N |
| Molecular Formula | C14H12O2 |
p-Fluorotoluene, 97%
CAS: 352-32-9 MDL Number: MFCD00000358 InChI Key: WRWPPGUCZBJXKX-UHFFFAOYSA-N Synonym: 4-fluorotoluene,p-fluorotoluene,benzene, 1-fluoro-4-methyl,p-fluoromethylbenzene,toluene, p-fluoro,1-methyl-4-fluorobenzene,p-fluoromethyl benzene,unii-nud6wz1b8f,p-tolyl fluoride,para-fluorotoluene PubChem CID: 9603 IUPAC Name: 1-fluoro-4-methylbenzene SMILES: CC1=CC=C(C=C1)F
| PubChem CID | 9603 |
|---|---|
| CAS | 352-32-9 |
| MDL Number | MFCD00000358 |
| SMILES | CC1=CC=C(C=C1)F |
| Synonym | 4-fluorotoluene,p-fluorotoluene,benzene, 1-fluoro-4-methyl,p-fluoromethylbenzene,toluene, p-fluoro,1-methyl-4-fluorobenzene,p-fluoromethyl benzene,unii-nud6wz1b8f,p-tolyl fluoride,para-fluorotoluene |
| IUPAC Name | 1-fluoro-4-methylbenzene |
| InChI Key | WRWPPGUCZBJXKX-UHFFFAOYSA-N |
2,3,5,6-Tetrafluoro-7,7,8,8-tetracyanoquinodimethane, 95%
CAS: 29261-33-4 Molecular Formula: C12F4N4 Molecular Weight (g/mol): 276.16 InChI Key: IXHWGNYCZPISET-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane,2,2'-perfluorocyclohexa-2,5-diene-1,4-diylidene dimalononitrile,tcnqf4,2,3,5,6-tetrafluorotetracyanoquinodimethane,f4-tcnq,tetrafluorotetracyanoquinodimethane,2-4-dicyanomethylidene-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene propanedinitrile,f4tcnq,tetrafluorotetracyanoquinodimethane anion radical,tetrafluorotetracyanoquinodimethane purifiedbysubl PubChem CID: 2733307 IUPAC Name: 2-[4-(dicyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile SMILES: C(#N)C(=C1C(=C(C(=C(C#N)C#N)C(=C1F)F)F)F)C#N
| PubChem CID | 2733307 |
|---|---|
| CAS | 29261-33-4 |
| Molecular Weight (g/mol) | 276.16 |
| SMILES | C(#N)C(=C1C(=C(C(=C(C#N)C#N)C(=C1F)F)F)F)C#N |
| Synonym | 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane,2,2'-perfluorocyclohexa-2,5-diene-1,4-diylidene dimalononitrile,tcnqf4,2,3,5,6-tetrafluorotetracyanoquinodimethane,f4-tcnq,tetrafluorotetracyanoquinodimethane,2-4-dicyanomethylidene-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene propanedinitrile,f4tcnq,tetrafluorotetracyanoquinodimethane anion radical,tetrafluorotetracyanoquinodimethane purifiedbysubl |
| IUPAC Name | 2-[4-(dicyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile |
| InChI Key | IXHWGNYCZPISET-UHFFFAOYSA-N |
| Molecular Formula | C12F4N4 |