Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.

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6,466 – 6,480 of 119,767 results

6,466

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

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Specifications

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

6,467

Methyl 3-Iodo-4-methylbenzoate 98.0+%, TCI America™

CAS: 90347-66-3 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.073 MDL Number: MFCD00230583 InChI Key: NKMHAOTZPFVSPC-UHFFFAOYSA-N Synonym: 3-iodo-4-methylbenzoic acid methyl ester,methyl 3-iodo-p-toluate,methyl-3-iodo-4-methylbenzoate,methyl 3-iodo-4-methyl-benzoate,2-iodo-4-methoxycarbonyl toluene,benzoic acid, 3-iodo-4-methyl-, methyl ester,methyl3-iodo-4-methylbenzoate,3-iodo-4-methylbenzoic acidmethyl ester,methyl 3-iodo-4-meth,ksc495m1r PubChem CID: 13614033 IUPAC Name: methyl 3-iodo-4-methylbenzoate SMILES: CC1=C(C=C(C=C1)C(=O)OC)I

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Specifications

PubChem CID	13614033
CAS	90347-66-3
Molecular Weight (g/mol)	276.073
MDL Number	MFCD00230583
SMILES	CC1=C(C=C(C=C1)C(=O)OC)I
Synonym	3-iodo-4-methylbenzoic acid methyl ester,methyl 3-iodo-p-toluate,methyl-3-iodo-4-methylbenzoate,methyl 3-iodo-4-methyl-benzoate,2-iodo-4-methoxycarbonyl toluene,benzoic acid, 3-iodo-4-methyl-, methyl ester,methyl3-iodo-4-methylbenzoate,3-iodo-4-methylbenzoic acidmethyl ester,methyl 3-iodo-4-meth,ksc495m1r
IUPAC Name	methyl 3-iodo-4-methylbenzoate
InChI Key	NKMHAOTZPFVSPC-UHFFFAOYSA-N
Molecular Formula	C9H9IO2

6,468

Tetrafluorophthalic Acid 98.0+%, TCI America™

CAS: 652-03-9 Molecular Formula: C8F4O4 Molecular Weight (g/mol): 236.08 MDL Number: MFCD00002407 InChI Key: YJLVXRPNNDKMMO-UHFFFAOYSA-L Synonym: tetrafluorophthalic acid,1,2-benzenedicarboxylic acid, 3,4,5,6-tetrafluoro,3,4,5,6-tetrafluorophthalic,2,3,4,5-tetrafluorophthalic acid,3,4,5,6-tetrafluorobenzene-1,2-dicarboxylic acid,2,3,4,5-tetrafluoro-phthalic acid,3,4,5,6-tetrafluoro-phthalic acid,tetrafluorobenzene-1,2-dicarboxylic acid,3,4,5,6-tetrafluoro-1,2-benzenedicarboxylic acid,pubchem1407 PubChem CID: 69544 IUPAC Name: tetrafluorobenzene-1,2-dicarboxylate SMILES: [O-]C(=O)C1=C(F)C(F)=C(F)C(F)=C1C([O-])=O

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Specifications

PubChem CID	69544
CAS	652-03-9
Molecular Weight (g/mol)	236.08
MDL Number	MFCD00002407
SMILES	[O-]C(=O)C1=C(F)C(F)=C(F)C(F)=C1C([O-])=O
Synonym	tetrafluorophthalic acid,1,2-benzenedicarboxylic acid, 3,4,5,6-tetrafluoro,3,4,5,6-tetrafluorophthalic,2,3,4,5-tetrafluorophthalic acid,3,4,5,6-tetrafluorobenzene-1,2-dicarboxylic acid,2,3,4,5-tetrafluoro-phthalic acid,3,4,5,6-tetrafluoro-phthalic acid,tetrafluorobenzene-1,2-dicarboxylic acid,3,4,5,6-tetrafluoro-1,2-benzenedicarboxylic acid,pubchem1407
IUPAC Name	tetrafluorobenzene-1,2-dicarboxylate
InChI Key	YJLVXRPNNDKMMO-UHFFFAOYSA-L
Molecular Formula	C8F4O4

6,469

4-(2-Hydroxyethoxy)salicylic Acid 97.0+%, TCI America™

CAS: 163451-82-9 Molecular Formula: C9H10O5 Molecular Weight (g/mol): 198.174 MDL Number: MFCD00143215 InChI Key: INEIMLMPQGJCGK-UHFFFAOYSA-N Synonym: 2-Hydroxy-4-(2-hydroxyethoxy)benzoic Acid PubChem CID: 586463 IUPAC Name: 2-hydroxy-4-(2-hydroxyethoxy)benzoic acid SMILES: C1=CC(=C(C=C1OCCO)O)C(=O)O

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Specifications

PubChem CID	586463
CAS	163451-82-9
Molecular Weight (g/mol)	198.174
MDL Number	MFCD00143215
SMILES	C1=CC(=C(C=C1OCCO)O)C(=O)O
Synonym	2-Hydroxy-4-(2-hydroxyethoxy)benzoic Acid
IUPAC Name	2-hydroxy-4-(2-hydroxyethoxy)benzoic acid
InChI Key	INEIMLMPQGJCGK-UHFFFAOYSA-N
Molecular Formula	C9H10O5

6,470

5-Iodo-o-toluic Acid 98.0+%, TCI America™

CAS: 54811-38-0 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.046 MDL Number: MFCD01570258 InChI Key: WUBHOZQZSHGUFI-UHFFFAOYSA-N Synonym: 5-Iodo-2-methylbenzoic Acid PubChem CID: 621745 IUPAC Name: 5-iodo-2-methylbenzoic acid SMILES: CC1=C(C=C(C=C1)I)C(=O)O

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Specifications

PubChem CID	621745
CAS	54811-38-0
Molecular Weight (g/mol)	262.046
MDL Number	MFCD01570258
SMILES	CC1=C(C=C(C=C1)I)C(=O)O
Synonym	5-Iodo-2-methylbenzoic Acid
IUPAC Name	5-iodo-2-methylbenzoic acid
InChI Key	WUBHOZQZSHGUFI-UHFFFAOYSA-N
Molecular Formula	C8H7IO2

6,471

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

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Specifications

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

6,472

2,4-Dichlorobenzoyl Chloride 97.0+%, TCI America™

CAS: 89-75-8 Molecular Formula: C7H3Cl3O Molecular Weight (g/mol): 209.45 MDL Number: MFCD00000661 InChI Key: CEOCVKWBUWKBKA-UHFFFAOYSA-N Synonym: benzoyl chloride, 2,4-dichloro,2,4-dichlorobenzoylchloride,benzoylchloride, 2,4-dichloro,ccris 8616,acmc-1cuf7,dsstox_cid_31176,dsstox_gsid_52603,2,4-dichloro benzoylchloride,2.4-dichlorobenzoyl chloride,ksc450c2p PubChem CID: 66645 IUPAC Name: 2,4-dichlorobenzoyl chloride SMILES: ClC(=O)C1=CC=C(Cl)C=C1Cl

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Specifications

PubChem CID	66645
CAS	89-75-8
Molecular Weight (g/mol)	209.45
MDL Number	MFCD00000661
SMILES	ClC(=O)C1=CC=C(Cl)C=C1Cl
Synonym	benzoyl chloride, 2,4-dichloro,2,4-dichlorobenzoylchloride,benzoylchloride, 2,4-dichloro,ccris 8616,acmc-1cuf7,dsstox_cid_31176,dsstox_gsid_52603,2,4-dichloro benzoylchloride,2.4-dichlorobenzoyl chloride,ksc450c2p
IUPAC Name	2,4-dichlorobenzoyl chloride
InChI Key	CEOCVKWBUWKBKA-UHFFFAOYSA-N
Molecular Formula	C7H3Cl3O

6,473

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

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Specifications

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

6,474

5-Bromo-4'-chlorosalicylanilide 98.0+%, TCI America™

CAS: 3679-64-9 Molecular Formula: C13H9BrClNO2 Molecular Weight (g/mol): 326.57 MDL Number: MFCD00020132 InChI Key: QBSGXIBYUQJHMJ-UHFFFAOYSA-N Synonym: 5-Bromo-4′C-chloro-2-hydroxybenzanilide PubChem CID: 77254 IUPAC Name: 5-bromo-N-(4-chlorophenyl)-2-hydroxybenzamide SMILES: OC1=CC=C(Br)C=C1C(=O)NC1=CC=C(Cl)C=C1

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Specifications

PubChem CID	77254
CAS	3679-64-9
Molecular Weight (g/mol)	326.57
MDL Number	MFCD00020132
SMILES	OC1=CC=C(Br)C=C1C(=O)NC1=CC=C(Cl)C=C1
Synonym	5-Bromo-4′C-chloro-2-hydroxybenzanilide
IUPAC Name	5-bromo-N-(4-chlorophenyl)-2-hydroxybenzamide
InChI Key	QBSGXIBYUQJHMJ-UHFFFAOYSA-N
Molecular Formula	C13H9BrClNO2

6,475

O-Acetylsalicyloyl Chloride 97.0+%, TCI America™

CAS: 5538-51-2 Molecular Formula: C9H7ClO3 Molecular Weight (g/mol): 198.602 MDL Number: MFCD00000663 InChI Key: DSGKWFGEUBCEIE-UHFFFAOYSA-N Synonym: 2-acetoxybenzoyl chloride,o-acetylsalicyloyl chloride,acetylsalicyloyl chloride,2-chlorocarbonyl phenyl acetate,benzoyl chloride, 2-acetyloxy,aspirin chloride,o-acetylsalicyloylchloride,acetylsalicoyl chloride,2-carbonochloridoyl phenyl acetate,ascc PubChem CID: 79668 IUPAC Name: (2-carbonochloridoylphenyl) acetate SMILES: CC(=O)OC1=CC=CC=C1C(=O)Cl

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Specifications

PubChem CID	79668
CAS	5538-51-2
Molecular Weight (g/mol)	198.602
MDL Number	MFCD00000663
SMILES	CC(=O)OC1=CC=CC=C1C(=O)Cl
Synonym	2-acetoxybenzoyl chloride,o-acetylsalicyloyl chloride,acetylsalicyloyl chloride,2-chlorocarbonyl phenyl acetate,benzoyl chloride, 2-acetyloxy,aspirin chloride,o-acetylsalicyloylchloride,acetylsalicoyl chloride,2-carbonochloridoyl phenyl acetate,ascc
IUPAC Name	(2-carbonochloridoylphenyl) acetate
InChI Key	DSGKWFGEUBCEIE-UHFFFAOYSA-N
Molecular Formula	C9H7ClO3

6,476

3-Methylsalicylic Acid 98.0+%, TCI America™

CAS: 83-40-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002448 InChI Key: WHSXTWFYRGOBGO-UHFFFAOYSA-N Synonym: 3-methylsalicylic acid,hydroxytoluic acid,o-cresotic acid,o-cresotinic acid,cresotic acid,o-homosalicylic acid,2-hydroxy-m-toluic acid,2,3-cresotinic acid,cresotinic acid,benzoic acid, 2-hydroxy-3-methyl PubChem CID: 6738 ChEBI: CHEBI:20141 IUPAC Name: 2-hydroxy-3-methylbenzoic acid SMILES: CC1=CC=CC(C(O)=O)=C1O

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Specifications

PubChem CID	6738
CAS	83-40-9
Molecular Weight (g/mol)	152.15
ChEBI	CHEBI:20141
MDL Number	MFCD00002448
SMILES	CC1=CC=CC(C(O)=O)=C1O
Synonym	3-methylsalicylic acid,hydroxytoluic acid,o-cresotic acid,o-cresotinic acid,cresotic acid,o-homosalicylic acid,2-hydroxy-m-toluic acid,2,3-cresotinic acid,cresotinic acid,benzoic acid, 2-hydroxy-3-methyl
IUPAC Name	2-hydroxy-3-methylbenzoic acid
InChI Key	WHSXTWFYRGOBGO-UHFFFAOYSA-N
Molecular Formula	C8H8O3

6,477

5-Chloro-2-nitrobenzamide 90.0+%, TCI America™

CAS: 40763-96-0 Molecular Formula: C7H5ClN2O3 Molecular Weight (g/mol): 200.578 InChI Key: MKHXTOPPKVFSFI-UHFFFAOYSA-N Synonym: benzamide, 5-chloro-2-nitro,acmc-209jgl,5-chloro-2-nitrobenzamid,2-nitro-5-chlorobenzamide,2-carbamoyl-4-chloronitrobenzene,5-chloro-2-nitrobenzamide PubChem CID: 2723672 IUPAC Name: 5-chloro-2-nitrobenzamide SMILES: C1=CC(=C(C=C1Cl)C(=O)N)[N+](=O)[O-]

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Specifications

PubChem CID	2723672
CAS	40763-96-0
Molecular Weight (g/mol)	200.578
SMILES	C1=CC(=C(C=C1Cl)C(=O)N)[N+](=O)[O-]
Synonym	benzamide, 5-chloro-2-nitro,acmc-209jgl,5-chloro-2-nitrobenzamid,2-nitro-5-chlorobenzamide,2-carbamoyl-4-chloronitrobenzene,5-chloro-2-nitrobenzamide
IUPAC Name	5-chloro-2-nitrobenzamide
InChI Key	MKHXTOPPKVFSFI-UHFFFAOYSA-N
Molecular Formula	C7H5ClN2O3

6,478

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

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Specifications

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

6,479

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

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Specifications

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

6,480

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

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Specifications

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

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