Benzenoids
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4,5-Dihydroxynaphthalene-2,7-disulfonic acid, disodium salt dihydrate, ACS reagent
CAS: 5808-22-0 Molecular Formula: C10H10Na2O10S2 Molecular Weight (g/mol): 400.28 MDL Number: MFCD00150612 InChI Key: QUEAKWJKJBFNEG-UHFFFAOYSA-L Synonym: chromotropic acid sodium salt,4,5-dihydroxy-2,7-naphthalenedisulfonate,di sodium; 4,5-dihydroxy-7-sulfo-naphthalene-2-sulfonic acid,4,5-dihydroxynaphthalene-2,7-disulfonic acid disodium salt dihydrate, acs 5g PubChem CID: 124202444 IUPAC Name: 2,7-disodium 4,5-dihydroxynaphthalene-2,7-disulfonate dihydrate SMILES: O.O.OC1=CC(=CC2=CC(=CC(O)=C12)S(=O)(=O)O[Na])S(=O)(=O)O[Na]
| PubChem CID | 124202444 |
|---|---|
| CAS | 5808-22-0 |
| Molecular Weight (g/mol) | 400.28 |
| MDL Number | MFCD00150612 |
| SMILES | O.O.OC1=CC(=CC2=CC(=CC(O)=C12)S(=O)(=O)O[Na])S(=O)(=O)O[Na] |
| Synonym | chromotropic acid sodium salt,4,5-dihydroxy-2,7-naphthalenedisulfonate,di sodium; 4,5-dihydroxy-7-sulfo-naphthalene-2-sulfonic acid,4,5-dihydroxynaphthalene-2,7-disulfonic acid disodium salt dihydrate, acs 5g |
| IUPAC Name | 2,7-disodium 4,5-dihydroxynaphthalene-2,7-disulfonate dihydrate |
| InChI Key | QUEAKWJKJBFNEG-UHFFFAOYSA-L |
| Molecular Formula | C10H10Na2O10S2 |
4-Methylbenzenesulfonhydrazide, 97%
CAS: 1576-35-8 Molecular Formula: C7H10N2O2S Molecular Weight (g/mol): 186.23 MDL Number: MFCD00007588 InChI Key: ICGLPKIVTVWCFT-UHFFFAOYSA-N Synonym: 4-methylbenzenesulfonhydrazide,p-toluenesulfonhydrazide,tosylhydrazine,p-toluenesulfonyl hydrazide,tosylhydrazide,p-tosylhydrazine,p-toluenesulfonylhydrazine,celogen tsh,ptsh,4-toluenesulfonyl hydrazide PubChem CID: 15303 SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN
| PubChem CID | 15303 |
|---|---|
| CAS | 1576-35-8 |
| Molecular Weight (g/mol) | 186.23 |
| MDL Number | MFCD00007588 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NN |
| Synonym | 4-methylbenzenesulfonhydrazide,p-toluenesulfonhydrazide,tosylhydrazine,p-toluenesulfonyl hydrazide,tosylhydrazide,p-tosylhydrazine,p-toluenesulfonylhydrazine,celogen tsh,ptsh,4-toluenesulfonyl hydrazide |
| InChI Key | ICGLPKIVTVWCFT-UHFFFAOYSA-N |
| Molecular Formula | C7H10N2O2S |
4,4'-Dimethoxytrityl Chloride, 98%
CAS: 40615-36-9 Molecular Formula: C21H19ClO2 Molecular Weight (g/mol): 338.83 MDL Number: MFCD00008409 InChI Key: JBWYRBLDOOOJEU-UHFFFAOYSA-N Synonym: 4,4'-dimethoxytrityl chloride,dmt-cl,4,4'-dimethoxytritylchloride,4,4'-chloro phenyl methylene bis methoxybenzene,4,4'-dimethoxytriphenylmethyl chloride,1,1'-chlorophenylmethylene bis 4-methoxybenzene,benzene, 1,1'-chlorophenylmethylene bis 4-methoxy,chloro-4,4'-dimethoxytriphenylmethane,1-chloro 4-methoxyphenyl phenylmethyl-4-methoxybenzene,4,4'-dimethoxytritylchloride dmt-cl PubChem CID: 96831 IUPAC Name: 1-[chloro-(4-methoxyphenyl)-phenylmethyl]-4-methoxybenzene SMILES: COC1=CC=C(C=C1)C(Cl)(C1=CC=CC=C1)C1=CC=C(OC)C=C1
| PubChem CID | 96831 |
|---|---|
| CAS | 40615-36-9 |
| Molecular Weight (g/mol) | 338.83 |
| MDL Number | MFCD00008409 |
| SMILES | COC1=CC=C(C=C1)C(Cl)(C1=CC=CC=C1)C1=CC=C(OC)C=C1 |
| Synonym | 4,4'-dimethoxytrityl chloride,dmt-cl,4,4'-dimethoxytritylchloride,4,4'-chloro phenyl methylene bis methoxybenzene,4,4'-dimethoxytriphenylmethyl chloride,1,1'-chlorophenylmethylene bis 4-methoxybenzene,benzene, 1,1'-chlorophenylmethylene bis 4-methoxy,chloro-4,4'-dimethoxytriphenylmethane,1-chloro 4-methoxyphenyl phenylmethyl-4-methoxybenzene,4,4'-dimethoxytritylchloride dmt-cl |
| IUPAC Name | 1-[chloro-(4-methoxyphenyl)-phenylmethyl]-4-methoxybenzene |
| InChI Key | JBWYRBLDOOOJEU-UHFFFAOYSA-N |
| Molecular Formula | C21H19ClO2 |
2-Nitrophenol, 99%
CAS: 88-75-5 Molecular Formula: C6H5NO3 Molecular Weight (g/mol): 139.11 MDL Number: MFCD00011688 InChI Key: IQUPABOKLQSFBK-UHFFFAOYSA-N Synonym: o-nitrophenol,2-hydroxynitrobenzene,phenol, 2-nitro,o-hydroxynitrobenzene,phenol, o-nitro,nitrophenol,o-nitrofenol,ortho-nitrophenol,phenol, nitro,o-nitrofenol czech PubChem CID: 6947 ChEBI: CHEBI:16260 IUPAC Name: 2-nitrophenol SMILES: OC1=CC=CC=C1[N+]([O-])=O
| PubChem CID | 6947 |
|---|---|
| CAS | 88-75-5 |
| Molecular Weight (g/mol) | 139.11 |
| ChEBI | CHEBI:16260 |
| MDL Number | MFCD00011688 |
| SMILES | OC1=CC=CC=C1[N+]([O-])=O |
| Synonym | o-nitrophenol,2-hydroxynitrobenzene,phenol, 2-nitro,o-hydroxynitrobenzene,phenol, o-nitro,nitrophenol,o-nitrofenol,ortho-nitrophenol,phenol, nitro,o-nitrofenol czech |
| IUPAC Name | 2-nitrophenol |
| InChI Key | IQUPABOKLQSFBK-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO3 |
2-Chlorobenzoic acid, 98%
CAS: 118-91-2 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00002412 InChI Key: IKCLCGXPQILATA-UHFFFAOYSA-N Synonym: o-chlorobenzoic acid,benzoic acid, o-chloro,benzoic acid, 2-chloro,2-cba,kyselina o-chlorbenzoova,chlorobenzoic acid,ocba,benzoic acid, chloro,2-chloro-benzoic acid,chlorobenzoate PubChem CID: 8374 ChEBI: CHEBI:30793 IUPAC Name: 2-chlorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Cl
| PubChem CID | 8374 |
|---|---|
| CAS | 118-91-2 |
| Molecular Weight (g/mol) | 156.57 |
| ChEBI | CHEBI:30793 |
| MDL Number | MFCD00002412 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)Cl |
| Synonym | o-chlorobenzoic acid,benzoic acid, o-chloro,benzoic acid, 2-chloro,2-cba,kyselina o-chlorbenzoova,chlorobenzoic acid,ocba,benzoic acid, chloro,2-chloro-benzoic acid,chlorobenzoate |
| IUPAC Name | 2-chlorobenzoic acid |
| InChI Key | IKCLCGXPQILATA-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |
Resorcinol, 98%
CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.11 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol PubChem CID: 5054 ChEBI: CHEBI:27810 IUPAC Name: benzene-1,3-diol SMILES: C1=CC(=CC(=C1)O)O
| PubChem CID | 5054 |
|---|---|
| CAS | 108-46-3 |
| Molecular Weight (g/mol) | 110.11 |
| ChEBI | CHEBI:27810 |
| MDL Number | MFCD00002269 |
| SMILES | C1=CC(=CC(=C1)O)O |
| Synonym | resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol |
| IUPAC Name | benzene-1,3-diol |
| InChI Key | GHMLBKRAJCXXBS-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2 |
4-Nitrophenol, 99%
CAS: 100-02-7 Molecular Formula: C6H5NO3 Molecular Weight (g/mol): 139.11 MDL Number: MFCD00007331 InChI Key: BTJIUGUIPKRLHP-UHFFFAOYSA-N Synonym: p-nitrophenol,phenol, 4-nitro,paranitrophenol,niphen,4-hydroxynitrobenzene,p-hydroxynitrobenzene,phenol, p-nitro,mononitrophenol,paranitrofenol,paranitrofenolo PubChem CID: 980 ChEBI: CHEBI:16836 IUPAC Name: 4-nitrophenol SMILES: OC1=CC=C(C=C1)[N+]([O-])=O
| PubChem CID | 980 |
|---|---|
| CAS | 100-02-7 |
| Molecular Weight (g/mol) | 139.11 |
| ChEBI | CHEBI:16836 |
| MDL Number | MFCD00007331 |
| SMILES | OC1=CC=C(C=C1)[N+]([O-])=O |
| Synonym | p-nitrophenol,phenol, 4-nitro,paranitrophenol,niphen,4-hydroxynitrobenzene,p-hydroxynitrobenzene,phenol, p-nitro,mononitrophenol,paranitrofenol,paranitrofenolo |
| IUPAC Name | 4-nitrophenol |
| InChI Key | BTJIUGUIPKRLHP-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO3 |
3,4-Dihydroxyphenylacetic acid, 98+%
CAS: 102-32-9 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00004338 InChI Key: CFFZDZCDUFSOFZ-UHFFFAOYSA-N Synonym: 3,4-dihydroxyphenylacetic acid,dopac,homoprotocatechuic acid,2-3,4-dihydroxyphenyl acetic acid,dopacetic acid,benzeneacetic acid, 3,4-dihydroxy,dihydroxyphenylacetic acid,3,4-dihydroxybenzeneacetic acid,4-carboxymethylcatechol,homoprotocatechuate PubChem CID: 547 ChEBI: CHEBI:41941 IUPAC Name: 2-(3,4-dihydroxyphenyl)acetic acid SMILES: C1=CC(=C(C=C1CC(=O)O)O)O
| PubChem CID | 547 |
|---|---|
| CAS | 102-32-9 |
| Molecular Weight (g/mol) | 168.148 |
| ChEBI | CHEBI:41941 |
| MDL Number | MFCD00004338 |
| SMILES | C1=CC(=C(C=C1CC(=O)O)O)O |
| Synonym | 3,4-dihydroxyphenylacetic acid,dopac,homoprotocatechuic acid,2-3,4-dihydroxyphenyl acetic acid,dopacetic acid,benzeneacetic acid, 3,4-dihydroxy,dihydroxyphenylacetic acid,3,4-dihydroxybenzeneacetic acid,4-carboxymethylcatechol,homoprotocatechuate |
| IUPAC Name | 2-(3,4-dihydroxyphenyl)acetic acid |
| InChI Key | CFFZDZCDUFSOFZ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
4-Chloro-3-methylphenol, 99+%
CAS: 59-50-7 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.58 MDL Number: MFCD00002323 InChI Key: CFKMVGJGLGKFKI-UHFFFAOYSA-N Synonym: chlorocresol,4-chloro-m-cresol,baktol,parol,p-chloro-m-cresol,ottafact,phenol, 4-chloro-3-methyl,4-chloro-3-cresol,candaseptic,baktolan PubChem CID: 1732 ChEBI: CHEBI:34395 IUPAC Name: 4-chloro-3-methylphenol SMILES: CC1=C(C=CC(=C1)O)Cl
| PubChem CID | 1732 |
|---|---|
| CAS | 59-50-7 |
| Molecular Weight (g/mol) | 142.58 |
| ChEBI | CHEBI:34395 |
| MDL Number | MFCD00002323 |
| SMILES | CC1=C(C=CC(=C1)O)Cl |
| Synonym | chlorocresol,4-chloro-m-cresol,baktol,parol,p-chloro-m-cresol,ottafact,phenol, 4-chloro-3-methyl,4-chloro-3-cresol,candaseptic,baktolan |
| IUPAC Name | 4-chloro-3-methylphenol |
| InChI Key | CFKMVGJGLGKFKI-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClO |
2,7-Dibromofluorene, 98%
CAS: 16433-88-8 Molecular Formula: C13H8Br2 Molecular Weight (g/mol): 324.02 MDL Number: MFCD00019048 InChI Key: AVXFJPFSWLMKSG-UHFFFAOYSA-N PubChem CID: 140073 IUPAC Name: 2,7-dibromo-9H-fluorene SMILES: BrC1=CC=C2C(CC3=CC(Br)=CC=C23)=C1
| PubChem CID | 140073 |
|---|---|
| CAS | 16433-88-8 |
| Molecular Weight (g/mol) | 324.02 |
| MDL Number | MFCD00019048 |
| SMILES | BrC1=CC=C2C(CC3=CC(Br)=CC=C23)=C1 |
| IUPAC Name | 2,7-dibromo-9H-fluorene |
| InChI Key | AVXFJPFSWLMKSG-UHFFFAOYSA-N |
| Molecular Formula | C13H8Br2 |
Methyl phenyl sulfone, 99%
CAS: 3112-85-4 Molecular Formula: C7H8O2S Molecular Weight (g/mol): 156.2 MDL Number: MFCD00014741 InChI Key: JCDWETOKTFWTHA-UHFFFAOYSA-N Synonym: methyl phenyl sulfone,methylsulfonyl benzene,phenyl methyl sulfone,benzene, methylsulfonyl,sulfone, methyl phenyl,phenylsulfonyl methane,methylphenylsulfone,methylsulphonyl benzene,methanesulfonylbenzene,methyl phenyl sulphone PubChem CID: 18369 IUPAC Name: methylsulfonylbenzene SMILES: CS(=O)(=O)C1=CC=CC=C1
| PubChem CID | 18369 |
|---|---|
| CAS | 3112-85-4 |
| Molecular Weight (g/mol) | 156.2 |
| MDL Number | MFCD00014741 |
| SMILES | CS(=O)(=O)C1=CC=CC=C1 |
| Synonym | methyl phenyl sulfone,methylsulfonyl benzene,phenyl methyl sulfone,benzene, methylsulfonyl,sulfone, methyl phenyl,phenylsulfonyl methane,methylphenylsulfone,methylsulphonyl benzene,methanesulfonylbenzene,methyl phenyl sulphone |
| IUPAC Name | methylsulfonylbenzene |
| InChI Key | JCDWETOKTFWTHA-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2S |
4-Dimethylaminobenzaldehyde, ACS reagent
CAS: 100-10-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00003381 InChI Key: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1
| PubChem CID | 7479 |
|---|---|
| CAS | 100-10-7 |
| Molecular Weight (g/mol) | 149.19 |
| MDL Number | MFCD00003381 |
| SMILES | CN(C)C1=CC=C(C=O)C=C1 |
| Synonym | 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal |
| IUPAC Name | 4-(dimethylamino)benzaldehyde |
| InChI Key | BGNGWHSBYQYVRX-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
m-Toluic acid, 99%
CAS: 99-04-7 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002523 InChI Key: GPSDUZXPYCFOSQ-UHFFFAOYSA-N Synonym: m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext PubChem CID: 7418 ChEBI: CHEBI:10589 IUPAC Name: 3-methylbenzoic acid SMILES: CC1=CC=CC(=C1)C(O)=O
| PubChem CID | 7418 |
|---|---|
| CAS | 99-04-7 |
| Molecular Weight (g/mol) | 136.15 |
| ChEBI | CHEBI:10589 |
| MDL Number | MFCD00002523 |
| SMILES | CC1=CC=CC(=C1)C(O)=O |
| Synonym | m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext |
| IUPAC Name | 3-methylbenzoic acid |
| InChI Key | GPSDUZXPYCFOSQ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
1,2-Naphthoquinone-4-sulfonic acid sodium salt, 97%
CAS: 521-24-4 Molecular Formula: C10H5NaO5S Molecular Weight (g/mol): 260.195 MDL Number: MFCD00001700 InChI Key: UBLXEEBHYISRFM-UHFFFAOYSA-M Synonym: 1,2-naphthoquinone-4-sulfonic acid sodium salt,sodium 1,2-naphthoquinone-4-sulfonate,sodium beta-naphthoquinone-4-sulfonate,sodium 3,4-dioxonaphthalene-1-sulfonate,sodium 3,4-dioxo-3,4-dihydronaphthalene-1-sulfonate,unii-t7185hp5sh,sodium 3,4-dioxonaphthalene-1-sulphonate,beta-naphthoquinone-4-sulfonate sodium salt,1-naphthalenesulfonic acid, 3,4-dihydro-3,4-dioxo-, sodium salt,chembl61245 PubChem CID: 516996 IUPAC Name: sodium;3,4-dioxonaphthalene-1-sulfonate SMILES: C1=CC=C2C(=C1)C(=CC(=O)C2=O)S(=O)(=O)[O-].[Na+]
| PubChem CID | 516996 |
|---|---|
| CAS | 521-24-4 |
| Molecular Weight (g/mol) | 260.195 |
| MDL Number | MFCD00001700 |
| SMILES | C1=CC=C2C(=C1)C(=CC(=O)C2=O)S(=O)(=O)[O-].[Na+] |
| Synonym | 1,2-naphthoquinone-4-sulfonic acid sodium salt,sodium 1,2-naphthoquinone-4-sulfonate,sodium beta-naphthoquinone-4-sulfonate,sodium 3,4-dioxonaphthalene-1-sulfonate,sodium 3,4-dioxo-3,4-dihydronaphthalene-1-sulfonate,unii-t7185hp5sh,sodium 3,4-dioxonaphthalene-1-sulphonate,beta-naphthoquinone-4-sulfonate sodium salt,1-naphthalenesulfonic acid, 3,4-dihydro-3,4-dioxo-, sodium salt,chembl61245 |
| IUPAC Name | sodium;3,4-dioxonaphthalene-1-sulfonate |
| InChI Key | UBLXEEBHYISRFM-UHFFFAOYSA-M |
| Molecular Formula | C10H5NaO5S |
p-Tolyl chloroformate, 97%
CAS: 937-62-2 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.6 MDL Number: MFCD00013255 InChI Key: XOFZPIYYMJUNRG-UHFFFAOYSA-N Synonym: p-tolyl chloroformate,4-methylphenyl chloroformate,p-tolylchloroformate,tolyl chloroformate,4-tolylchloroformate,p-tolyl-chloroformate,4-tolyl chloroformate,p-tolyl carbonochloridate,p-methylphenyl chloroformate PubChem CID: 70304 IUPAC Name: (4-methylphenyl) carbonochloridate SMILES: CC1=CC=C(C=C1)OC(=O)Cl
| PubChem CID | 70304 |
|---|---|
| CAS | 937-62-2 |
| Molecular Weight (g/mol) | 170.6 |
| MDL Number | MFCD00013255 |
| SMILES | CC1=CC=C(C=C1)OC(=O)Cl |
| Synonym | p-tolyl chloroformate,4-methylphenyl chloroformate,p-tolylchloroformate,tolyl chloroformate,4-tolylchloroformate,p-tolyl-chloroformate,4-tolyl chloroformate,p-tolyl carbonochloridate,p-methylphenyl chloroformate |
| IUPAC Name | (4-methylphenyl) carbonochloridate |
| InChI Key | XOFZPIYYMJUNRG-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |