Benzene and substituted derivatives
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Phenyl Dichlorophosphate 98.0+%, TCI America™
CAS: 770-12-7 Molecular Formula: C6H5Cl2O2P Molecular Weight (g/mol): 210.978 MDL Number: MFCD00002067 InChI Key: TXFOLHZMICYNRM-UHFFFAOYSA-N Synonym: phenyl dichlorophosphate,phenyl phosphorodichloridate,dichlorophenoxyphosphine oxide,phosphorodichloridic acid, phenyl ester,phenylphosphoric dichloride,phenyl phosphorodichlorodate,phenoxydichlorophosphine oxide,phenyldichlorophosphate,phenoxyphosphoryl dichloride,phosphoroyl dichloride phenyl ester PubChem CID: 13038 IUPAC Name: dichlorophosphoryloxybenzene SMILES: C1=CC=C(C=C1)OP(=O)(Cl)Cl
| PubChem CID | 13038 |
|---|---|
| CAS | 770-12-7 |
| Molecular Weight (g/mol) | 210.978 |
| MDL Number | MFCD00002067 |
| SMILES | C1=CC=C(C=C1)OP(=O)(Cl)Cl |
| Synonym | phenyl dichlorophosphate,phenyl phosphorodichloridate,dichlorophenoxyphosphine oxide,phosphorodichloridic acid, phenyl ester,phenylphosphoric dichloride,phenyl phosphorodichlorodate,phenoxydichlorophosphine oxide,phenyldichlorophosphate,phenoxyphosphoryl dichloride,phosphoroyl dichloride phenyl ester |
| IUPAC Name | dichlorophosphoryloxybenzene |
| InChI Key | TXFOLHZMICYNRM-UHFFFAOYSA-N |
| Molecular Formula | C6H5Cl2O2P |
4-Chlorobenzamide 98.0+%, TCI America™
CAS: 619-56-7 Molecular Formula: C7H6ClNO Molecular Weight (g/mol): 155.58 MDL Number: MFCD00007993 InChI Key: BLNVISNJTIRAHF-UHFFFAOYSA-N Synonym: p-chlorobenzamide,benzamide, 4-chloro,4-chloro-benzamide,p-chlorobenzoic acid amide,benzamide, p-chloro,unii-260cv6k0mr,benzamide, p-chloro-6ci,7ci,8ci,4-chloranylbenzamide,pubchem3619,4-chlorobenzenecarboxamide PubChem CID: 12084 IUPAC Name: 4-chlorobenzamide SMILES: NC(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 12084 |
|---|---|
| CAS | 619-56-7 |
| Molecular Weight (g/mol) | 155.58 |
| MDL Number | MFCD00007993 |
| SMILES | NC(=O)C1=CC=C(Cl)C=C1 |
| Synonym | p-chlorobenzamide,benzamide, 4-chloro,4-chloro-benzamide,p-chlorobenzoic acid amide,benzamide, p-chloro,unii-260cv6k0mr,benzamide, p-chloro-6ci,7ci,8ci,4-chloranylbenzamide,pubchem3619,4-chlorobenzenecarboxamide |
| IUPAC Name | 4-chlorobenzamide |
| InChI Key | BLNVISNJTIRAHF-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO |
2,3,4,5-Tetrachlorobenzoyl Chloride 98.0+%, TCI America™
CAS: 42221-52-3 Molecular Formula: C7HCl5O Molecular Weight (g/mol): 278.33 MDL Number: MFCD08460213 InChI Key: IROWIXYGGPOJFJ-UHFFFAOYSA-N PubChem CID: 5463797 IUPAC Name: 2,3,4,5-tetrachlorobenzoyl chloride SMILES: ClC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1Cl
| PubChem CID | 5463797 |
|---|---|
| CAS | 42221-52-3 |
| Molecular Weight (g/mol) | 278.33 |
| MDL Number | MFCD08460213 |
| SMILES | ClC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1Cl |
| IUPAC Name | 2,3,4,5-tetrachlorobenzoyl chloride |
| InChI Key | IROWIXYGGPOJFJ-UHFFFAOYSA-N |
| Molecular Formula | C7HCl5O |
Ethyl 3-Iodobenzoate 98.0+%, TCI America™
CAS: 58313-23-8 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.073 MDL Number: MFCD00044769 InChI Key: POGCXCWRMMXDAQ-UHFFFAOYSA-N Synonym: ethyl-3-iodobenzoate,3-iodobenzoic acid ethyl ester,benzoic acid, 3-iodo-, ethyl ester,ethyl m-iodobenzoate,m-iodobenzoic acid ethyl ester,pubchem3883,ethyl-3-iodo-benzoate,acmc-1aupw,ethyl 3-iodobenzoate,rarechem al bi 0709 PubChem CID: 143542 IUPAC Name: ethyl 3-iodobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)I
| PubChem CID | 143542 |
|---|---|
| CAS | 58313-23-8 |
| Molecular Weight (g/mol) | 276.073 |
| MDL Number | MFCD00044769 |
| SMILES | CCOC(=O)C1=CC(=CC=C1)I |
| Synonym | ethyl-3-iodobenzoate,3-iodobenzoic acid ethyl ester,benzoic acid, 3-iodo-, ethyl ester,ethyl m-iodobenzoate,m-iodobenzoic acid ethyl ester,pubchem3883,ethyl-3-iodo-benzoate,acmc-1aupw,ethyl 3-iodobenzoate,rarechem al bi 0709 |
| IUPAC Name | ethyl 3-iodobenzoate |
| InChI Key | POGCXCWRMMXDAQ-UHFFFAOYSA-N |
| Molecular Formula | C9H9IO2 |
3-Fluorobenzamide 97.0+%, TCI America™
CAS: 455-37-8 Molecular Formula: C7H6FNO Molecular Weight (g/mol): 139.13 MDL Number: MFCD00007983 InChI Key: YPIGHNIIXYSPKF-UHFFFAOYSA-N Synonym: m-fluorobenzamide,benzamide, 3-fluoro,3-fluoro-benzamide,benzamide, m-fluoro,3-fluoranylbenzamide,3-fluorobenzamide,ksc492m7t,ypighniixyspkf-uhfffaoysa PubChem CID: 68000 IUPAC Name: 3-fluorobenzamide SMILES: NC(=O)C1=CC=CC(F)=C1
| PubChem CID | 68000 |
|---|---|
| CAS | 455-37-8 |
| Molecular Weight (g/mol) | 139.13 |
| MDL Number | MFCD00007983 |
| SMILES | NC(=O)C1=CC=CC(F)=C1 |
| Synonym | m-fluorobenzamide,benzamide, 3-fluoro,3-fluoro-benzamide,benzamide, m-fluoro,3-fluoranylbenzamide,3-fluorobenzamide,ksc492m7t,ypighniixyspkf-uhfffaoysa |
| IUPAC Name | 3-fluorobenzamide |
| InChI Key | YPIGHNIIXYSPKF-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO |
2-Chloro-3-methylbenzoic Acid 98.0+%, TCI America™
CAS: 15068-35-6 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00079736 InChI Key: LWOKLXMNGXXORN-UHFFFAOYSA-N Synonym: 2-Chloro-m-toluic Acid PubChem CID: 139879 IUPAC Name: 2-chloro-3-methylbenzoic acid SMILES: CC1=CC=CC(C(O)=O)=C1Cl
| PubChem CID | 139879 |
|---|---|
| CAS | 15068-35-6 |
| Molecular Weight (g/mol) | 170.59 |
| MDL Number | MFCD00079736 |
| SMILES | CC1=CC=CC(C(O)=O)=C1Cl |
| Synonym | 2-Chloro-m-toluic Acid |
| IUPAC Name | 2-chloro-3-methylbenzoic acid |
| InChI Key | LWOKLXMNGXXORN-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
Methyl 5-Bromo-2-methylbenzoate 98.0+%, TCI America™
CAS: 79669-50-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD09839555 InChI Key: FDCYLMYCHALQJR-UHFFFAOYSA-N Synonym: methyl 5-bromo-2-methyl-benzoate,methyl 5-bromo-o-toluate,methyl5-bromo-2-methylbenzoate,5-bromo-2-methyl-benzoic acid methyl ester,benzoic acid, 5-bromo-2-methyl-, methyl ester,5-bromo-2-methylbenzoic acid methyl ester,5-bromo-2-methylbenzoicacid,methyl 4-bromo-toluate,pubchem10936,acmc-1bhme PubChem CID: 316201 IUPAC Name: methyl 5-bromo-2-methylbenzoate SMILES: CC1=C(C=C(C=C1)Br)C(=O)OC
| PubChem CID | 316201 |
|---|---|
| CAS | 79669-50-4 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD09839555 |
| SMILES | CC1=C(C=C(C=C1)Br)C(=O)OC |
| Synonym | methyl 5-bromo-2-methyl-benzoate,methyl 5-bromo-o-toluate,methyl5-bromo-2-methylbenzoate,5-bromo-2-methyl-benzoic acid methyl ester,benzoic acid, 5-bromo-2-methyl-, methyl ester,5-bromo-2-methylbenzoic acid methyl ester,5-bromo-2-methylbenzoicacid,methyl 4-bromo-toluate,pubchem10936,acmc-1bhme |
| IUPAC Name | methyl 5-bromo-2-methylbenzoate |
| InChI Key | FDCYLMYCHALQJR-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Tetrachlorophthalic Acid Hemihydrate 98.0+%, TCI America™
CAS: 632-58-6 Molecular Formula: C8H2Cl4O4 Molecular Weight (g/mol): 303.90 MDL Number: MFCD00053309 InChI Key: WZHHYIOUKQNLQM-UHFFFAOYSA-N PubChem CID: 12442 IUPAC Name: tetrachlorobenzene-1,2-dicarboxylic acid SMILES: OC(=O)C1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1C(O)=O
| PubChem CID | 12442 |
|---|---|
| CAS | 632-58-6 |
| Molecular Weight (g/mol) | 303.90 |
| MDL Number | MFCD00053309 |
| SMILES | OC(=O)C1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1C(O)=O |
| IUPAC Name | tetrachlorobenzene-1,2-dicarboxylic acid |
| InChI Key | WZHHYIOUKQNLQM-UHFFFAOYSA-N |
| Molecular Formula | C8H2Cl4O4 |
Methyl 2-Chloro-4-fluorobenzoate 98.0+%, TCI America™
CAS: 85953-29-3 Molecular Formula: C8H6ClFO2 Molecular Weight (g/mol): 188.582 MDL Number: MFCD00173937 InChI Key: YZDLPZNWBRBZMZ-UHFFFAOYSA-N Synonym: 2-chloro-4-fluorobenzoic acid methyl ester,methyl 2-chloro-4-fluorobenzenecarboxylate,benzoic acid, 2-chloro-4-fluoro-, methyl ester,2-chloro-4-fluoro-benzoic acid methyl ester,pubchem18760,rarechem al bf 0289,acmc-209q7x,ksc495c1p,methyl 2-chloro-4-fluorob...,methy 2-chloro-4-fluorobenzoate PubChem CID: 2763551 IUPAC Name: methyl 2-chloro-4-fluorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)F)Cl
| PubChem CID | 2763551 |
|---|---|
| CAS | 85953-29-3 |
| Molecular Weight (g/mol) | 188.582 |
| MDL Number | MFCD00173937 |
| SMILES | COC(=O)C1=C(C=C(C=C1)F)Cl |
| Synonym | 2-chloro-4-fluorobenzoic acid methyl ester,methyl 2-chloro-4-fluorobenzenecarboxylate,benzoic acid, 2-chloro-4-fluoro-, methyl ester,2-chloro-4-fluoro-benzoic acid methyl ester,pubchem18760,rarechem al bf 0289,acmc-209q7x,ksc495c1p,methyl 2-chloro-4-fluorob...,methy 2-chloro-4-fluorobenzoate |
| IUPAC Name | methyl 2-chloro-4-fluorobenzoate |
| InChI Key | YZDLPZNWBRBZMZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO2 |
Methyl 3-Amino-4-chlorobenzoate 98.0+%, TCI America™
CAS: 40872-87-5 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.607 InChI Key: LOCJPOYKBUUVKU-UHFFFAOYSA-N Synonym: 3-Amino-4-chlorobenzoic Acid Methyl Ester PubChem CID: 593055 IUPAC Name: methyl 3-amino-4-chlorobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)Cl)N
| PubChem CID | 593055 |
|---|---|
| CAS | 40872-87-5 |
| Molecular Weight (g/mol) | 185.607 |
| SMILES | COC(=O)C1=CC(=C(C=C1)Cl)N |
| Synonym | 3-Amino-4-chlorobenzoic Acid Methyl Ester |
| IUPAC Name | methyl 3-amino-4-chlorobenzoate |
| InChI Key | LOCJPOYKBUUVKU-UHFFFAOYSA-N |
| Molecular Formula | C8H8ClNO2 |
2-Chloro-4-nitrobenzoyl Chloride 98.0+%, TCI America™
CAS: 7073-36-1 Molecular Formula: C7H3Cl2NO3 Molecular Weight (g/mol): 220.01 MDL Number: MFCD00051515 InChI Key: KTHNITVDTYAHFF-UHFFFAOYSA-N Synonym: benzoyl chloride, 2-chloro-4-nitro,benzoyl chloride,2-chloro-4-nitro,acmc-209ofu,2-chloro-4-nitro-benzoyl chloride PubChem CID: 81522 IUPAC Name: 2-chloro-4-nitrobenzoyl chloride SMILES: [O-][N+](=O)C1=CC=C(C(Cl)=O)C(Cl)=C1
| PubChem CID | 81522 |
|---|---|
| CAS | 7073-36-1 |
| Molecular Weight (g/mol) | 220.01 |
| MDL Number | MFCD00051515 |
| SMILES | [O-][N+](=O)C1=CC=C(C(Cl)=O)C(Cl)=C1 |
| Synonym | benzoyl chloride, 2-chloro-4-nitro,benzoyl chloride,2-chloro-4-nitro,acmc-209ofu,2-chloro-4-nitro-benzoyl chloride |
| IUPAC Name | 2-chloro-4-nitrobenzoyl chloride |
| InChI Key | KTHNITVDTYAHFF-UHFFFAOYSA-N |
| Molecular Formula | C7H3Cl2NO3 |
Pentafluorobenzoic Acid 98.0+%, TCI America™
CAS: 602-94-8 Molecular Formula: C7HF5O2 Molecular Weight (g/mol): 212.08 MDL Number: MFCD00002406 InChI Key: YZERDTREOUSUHF-UHFFFAOYSA-N Synonym: pentafluorobenzoic acid,perfluorobenzoic acid,benzoic acid, pentafluoro,benzoic acid, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzoicacid,pubchem2320,acmc-1b1wz,4-09-00-00956 beilstein handbook reference,ksc355e3b,rarechem al bo 0017 PubChem CID: 11770 ChEBI: CHEBI:46796 IUPAC Name: pentafluorobenzoic acid SMILES: OC(=O)C1=C(F)C(F)=C(F)C(F)=C1F
| PubChem CID | 11770 |
|---|---|
| CAS | 602-94-8 |
| Molecular Weight (g/mol) | 212.08 |
| ChEBI | CHEBI:46796 |
| MDL Number | MFCD00002406 |
| SMILES | OC(=O)C1=C(F)C(F)=C(F)C(F)=C1F |
| Synonym | pentafluorobenzoic acid,perfluorobenzoic acid,benzoic acid, pentafluoro,benzoic acid, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzoicacid,pubchem2320,acmc-1b1wz,4-09-00-00956 beilstein handbook reference,ksc355e3b,rarechem al bo 0017 |
| IUPAC Name | pentafluorobenzoic acid |
| InChI Key | YZERDTREOUSUHF-UHFFFAOYSA-N |
| Molecular Formula | C7HF5O2 |
3-Chlorobenzohydrazide 98.0+%, TCI America™
CAS: 1673-47-8 Molecular Formula: C7H7ClN2O Molecular Weight (g/mol): 170.596 MDL Number: MFCD00014757 InChI Key: PHRDZSRVSVNQRN-UHFFFAOYSA-N Synonym: 3-chlorobenzhydrazide,3-chlorobenzenecarbohydrazide,3-chlorobenzoic hydrazide,benzoic acid, 3-chloro-, hydrazide,3-chlorobenzoylhydrazine,3-chlorobenzoic acid hydrazide,3-chloro-benzoic acid hydrazide,benzoylhydrazine, m-chloro,3-chlorobenzoic acid, hydrazide,3-chlorobenzhyrazide PubChem CID: 74289 IUPAC Name: 3-chlorobenzohydrazide SMILES: C1=CC(=CC(=C1)Cl)C(=O)NN
| PubChem CID | 74289 |
|---|---|
| CAS | 1673-47-8 |
| Molecular Weight (g/mol) | 170.596 |
| MDL Number | MFCD00014757 |
| SMILES | C1=CC(=CC(=C1)Cl)C(=O)NN |
| Synonym | 3-chlorobenzhydrazide,3-chlorobenzenecarbohydrazide,3-chlorobenzoic hydrazide,benzoic acid, 3-chloro-, hydrazide,3-chlorobenzoylhydrazine,3-chlorobenzoic acid hydrazide,3-chloro-benzoic acid hydrazide,benzoylhydrazine, m-chloro,3-chlorobenzoic acid, hydrazide,3-chlorobenzhyrazide |
| IUPAC Name | 3-chlorobenzohydrazide |
| InChI Key | PHRDZSRVSVNQRN-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClN2O |
Ethyl Pentafluorobenzoate 98.0+%, TCI America™
CAS: 4522-93-4 Molecular Formula: C9H5F5O2 Molecular Weight (g/mol): 240.13 MDL Number: MFCD00039211 InChI Key: DFUDMSIRGGTHGI-UHFFFAOYSA-N Synonym: ethyl pentafluorobenzoate,ethyl perfluorobenzoate,pentafluorobenzoic acid ethyl ester,2,3,4,5,6-pentafluoro-benzoic acid ethyl ester,benzoic acid, pentafluoro-, ethyl ester,ethylpentafluorobenzoate,acmc-1ajj1,rarechem al bi 0017,perfluorobenzoic acid ethyl ester PubChem CID: 78283 IUPAC Name: ethyl 2,3,4,5,6-pentafluorobenzoate SMILES: CCOC(=O)C1=C(F)C(F)=C(F)C(F)=C1F
| PubChem CID | 78283 |
|---|---|
| CAS | 4522-93-4 |
| Molecular Weight (g/mol) | 240.13 |
| MDL Number | MFCD00039211 |
| SMILES | CCOC(=O)C1=C(F)C(F)=C(F)C(F)=C1F |
| Synonym | ethyl pentafluorobenzoate,ethyl perfluorobenzoate,pentafluorobenzoic acid ethyl ester,2,3,4,5,6-pentafluoro-benzoic acid ethyl ester,benzoic acid, pentafluoro-, ethyl ester,ethylpentafluorobenzoate,acmc-1ajj1,rarechem al bi 0017,perfluorobenzoic acid ethyl ester |
| IUPAC Name | ethyl 2,3,4,5,6-pentafluorobenzoate |
| InChI Key | DFUDMSIRGGTHGI-UHFFFAOYSA-N |
| Molecular Formula | C9H5F5O2 |