Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.

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7,531 – 7,545 of 78,418 results

7,531

1,3-Dibromo-5-n-octylbenzene 98.0+%, TCI America™

CAS: 75894-99-4 Molecular Formula: C14H20Br2 Molecular Weight (g/mol): 348.122 InChI Key: OHOXSSBAVJERNK-UHFFFAOYSA-N PubChem CID: 101748485 IUPAC Name: 1,3-dibromo-5-octylbenzene SMILES: CCCCCCCCC1=CC(=CC(=C1)Br)Br

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PubChem CID	101748485
CAS	75894-99-4
Molecular Weight (g/mol)	348.122
SMILES	CCCCCCCCC1=CC(=CC(=C1)Br)Br
IUPAC Name	1,3-dibromo-5-octylbenzene
InChI Key	OHOXSSBAVJERNK-UHFFFAOYSA-N
Molecular Formula	C14H20Br2

7,532

1-Bromo-2-ethylbenzene 98.0+%, TCI America™

CAS: 1973-22-4 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000077 InChI Key: HVRUGFJYCAFAAN-UHFFFAOYSA-N PubChem CID: 16089 IUPAC Name: 1-bromo-2-ethylbenzene SMILES: CCC1=CC=CC=C1Br

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PubChem CID	16089
CAS	1973-22-4
Molecular Weight (g/mol)	185.064
MDL Number	MFCD00000077
SMILES	CCC1=CC=CC=C1Br
IUPAC Name	1-bromo-2-ethylbenzene
InChI Key	HVRUGFJYCAFAAN-UHFFFAOYSA-N
Molecular Formula	C8H9Br

7,533

2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine 98.0+%, TCI America™

CAS: 927384-43-8 Molecular Formula: C16H12BBrN2 Molecular Weight (g/mol): 323 MDL Number: MFCD16038145 InChI Key: RDGOAMRKYXEHHS-UHFFFAOYSA-N Synonym: 3-Bromo-1-(2,3-dihydro-1H-naphtho[1,8-de]-1,3,2-diazaborinyl)benzene, 2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine PubChem CID: 53384412 SMILES: B1(NC2=CC=CC3=C2C(=CC=C3)N1)C4=CC(=CC=C4)Br

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PubChem CID	53384412
CAS	927384-43-8
Molecular Weight (g/mol)	323
MDL Number	MFCD16038145
SMILES	B1(NC2=CC=CC3=C2C(=CC=C3)N1)C4=CC(=CC=C4)Br
Synonym	3-Bromo-1-(2,3-dihydro-1H-naphtho[1,8-de]-1,3,2-diazaborinyl)benzene, 2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine
InChI Key	RDGOAMRKYXEHHS-UHFFFAOYSA-N
Molecular Formula	C16H12BBrN2

7,534

alpha,alpha,alpha',alpha',4,5-Hexabromo-o-xylene 98.0+%, TCI America™

CAS: 13209-20-6 Molecular Formula: C8H4Br6 Molecular Weight (g/mol): 579.544 MDL Number: MFCD00191445 InChI Key: QPLVNMIEWOGDBY-UHFFFAOYSA-N PubChem CID: 12186451 IUPAC Name: 1,2-dibromo-4,5-bis(dibromomethyl)benzene SMILES: C1=C(C(=CC(=C1Br)Br)C(Br)Br)C(Br)Br

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Specifications

PubChem CID	12186451
CAS	13209-20-6
Molecular Weight (g/mol)	579.544
MDL Number	MFCD00191445
SMILES	C1=C(C(=CC(=C1Br)Br)C(Br)Br)C(Br)Br
IUPAC Name	1,2-dibromo-4,5-bis(dibromomethyl)benzene
InChI Key	QPLVNMIEWOGDBY-UHFFFAOYSA-N
Molecular Formula	C8H4Br6

7,535

(R)-(+)-1-(4-Bromophenyl)ethylamine 98.0+%, TCI America™

CAS: 45791-36-4 Molecular Formula: C8H10BrN Molecular Weight (g/mol): 200.079 MDL Number: MFCD00066025 InChI Key: SOZMSEPDYJGBEK-ZCFIWIBFSA-N Synonym: r-1-4-bromophenyl ethylamine,r-+-1-4-bromophenyl ethylamine,r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethan-1-amine,r-1-4-bromophenyl-ethylamine,r-4-bromo-alpha-methylbenzylamine,r-+-4-bromo a-methylbenzylamine,p-bromo-a-methylbenzylamine,pubchem14234 PubChem CID: 853000 IUPAC Name: (1R)-1-(4-bromophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)Br)N

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Specifications

PubChem CID	853000
CAS	45791-36-4
Molecular Weight (g/mol)	200.079
MDL Number	MFCD00066025
SMILES	CC(C1=CC=C(C=C1)Br)N
Synonym	r-1-4-bromophenyl ethylamine,r-+-1-4-bromophenyl ethylamine,r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethan-1-amine,r-1-4-bromophenyl-ethylamine,r-4-bromo-alpha-methylbenzylamine,r-+-4-bromo a-methylbenzylamine,p-bromo-a-methylbenzylamine,pubchem14234
IUPAC Name	(1R)-1-(4-bromophenyl)ethanamine
InChI Key	SOZMSEPDYJGBEK-ZCFIWIBFSA-N
Molecular Formula	C8H10BrN

7,536

3-Bromophenylsulfur Pentafluoride 95.0+%, TCI America™

CAS: 672-30-0 Molecular Formula: C6H4BrF5S Molecular Weight (g/mol): 283.05 MDL Number: MFCD03425927 InChI Key: QRPMKEUTGAXKSD-UHFFFAOYSA-N PubChem CID: 2779192 IUPAC Name: 1-bromo-3-(pentafluoro-λ⁶-sulfanyl)benzene SMILES: FS(F)(F)(F)(F)C1=CC(Br)=CC=C1

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Specifications

PubChem CID	2779192
CAS	672-30-0
Molecular Weight (g/mol)	283.05
MDL Number	MFCD03425927
SMILES	FS(F)(F)(F)(F)C1=CC(Br)=CC=C1
IUPAC Name	1-bromo-3-(pentafluoro-λ⁶-sulfanyl)benzene
InChI Key	QRPMKEUTGAXKSD-UHFFFAOYSA-N
Molecular Formula	C6H4BrF5S

7,537

2-Chlorobenzamide 98.0+%, TCI America™

CAS: 609-66-5 Molecular Formula: C7H6ClNO Molecular Weight (g/mol): 155.58 MDL Number: MFCD00007973 InChI Key: RBGDLYUEXLWQBZ-UHFFFAOYSA-N Synonym: o-chlorobenzamide,benzamide, 2-chloro,benzamide, o-chloro,o-chloro-benzamide,unii-ke1m5i9i32,chlorobenzamide,pubchem3617,acmc-1aupu,2-chlorobenzamide,dsstox_cid_30850 PubChem CID: 69111 IUPAC Name: 2-chlorobenzamide SMILES: NC(=O)C1=CC=CC=C1Cl

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Specifications

PubChem CID	69111
CAS	609-66-5
Molecular Weight (g/mol)	155.58
MDL Number	MFCD00007973
SMILES	NC(=O)C1=CC=CC=C1Cl
Synonym	o-chlorobenzamide,benzamide, 2-chloro,benzamide, o-chloro,o-chloro-benzamide,unii-ke1m5i9i32,chlorobenzamide,pubchem3617,acmc-1aupu,2-chlorobenzamide,dsstox_cid_30850
IUPAC Name	2-chlorobenzamide
InChI Key	RBGDLYUEXLWQBZ-UHFFFAOYSA-N
Molecular Formula	C7H6ClNO

7,538

4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide 98.0+%, TCI America™

CAS: 41859-57-8 Molecular Formula: C15H14ClNO2 Molecular Weight (g/mol): 275.73 MDL Number: MFCD00218513 InChI Key: ZTLWJYCDAXUIBK-UHFFFAOYSA-N Synonym: n-4-chlorobenzoyl-tyramine,4-chloro-n-4-hydroxyphenethyl benzamide,4-chloro-n-2-4-hydroxyphenyl ethyl benzamide,n-4-chlorobenzoyl tyramine,benzamide, p-chloro-n-2-p-hydroxyphenyl ethyl,p-chloro-n-2-p-hydroxyphenyl ethyl benzamide,benzamide, 4-chloro-n-2-4-hydroxyphenyl ethyl,bez-da PubChem CID: 198234 IUPAC Name: 4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide SMILES: OC1=CC=C(CCNC(=O)C2=CC=C(Cl)C=C2)C=C1

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Specifications

PubChem CID	198234
CAS	41859-57-8
Molecular Weight (g/mol)	275.73
MDL Number	MFCD00218513
SMILES	OC1=CC=C(CCNC(=O)C2=CC=C(Cl)C=C2)C=C1
Synonym	n-4-chlorobenzoyl-tyramine,4-chloro-n-4-hydroxyphenethyl benzamide,4-chloro-n-2-4-hydroxyphenyl ethyl benzamide,n-4-chlorobenzoyl tyramine,benzamide, p-chloro-n-2-p-hydroxyphenyl ethyl,p-chloro-n-2-p-hydroxyphenyl ethyl benzamide,benzamide, 4-chloro-n-2-4-hydroxyphenyl ethyl,bez-da
IUPAC Name	4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
InChI Key	ZTLWJYCDAXUIBK-UHFFFAOYSA-N
Molecular Formula	C15H14ClNO2

7,539

3-Iodobenzoyl Chloride 98.0+%, TCI America™

CAS: 1711-10-0 Molecular Formula: C7H4ClIO Molecular Weight (g/mol): 266.462 MDL Number: MFCD02093934 InChI Key: DTELTOREECFDBC-UHFFFAOYSA-N Synonym: 3-iodobenzoylchloride,m-iodobenzoyl chloride,benzoyl chloride, 3-iodo,3-iodo benzoyl chloride,3-iodo-benzoyl chloride,benzoylchloride,3-iodo,benzoyl chloride,3-iodo,acmc-1bql4,3-iodobenzoic acid chloride,3-iodobenzoyl chloride, 97+% PubChem CID: 74378 IUPAC Name: 3-iodobenzoyl chloride SMILES: C1=CC(=CC(=C1)I)C(=O)Cl

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Specifications

PubChem CID	74378
CAS	1711-10-0
Molecular Weight (g/mol)	266.462
MDL Number	MFCD02093934
SMILES	C1=CC(=CC(=C1)I)C(=O)Cl
Synonym	3-iodobenzoylchloride,m-iodobenzoyl chloride,benzoyl chloride, 3-iodo,3-iodo benzoyl chloride,3-iodo-benzoyl chloride,benzoylchloride,3-iodo,benzoyl chloride,3-iodo,acmc-1bql4,3-iodobenzoic acid chloride,3-iodobenzoyl chloride, 97+%
IUPAC Name	3-iodobenzoyl chloride
InChI Key	DTELTOREECFDBC-UHFFFAOYSA-N
Molecular Formula	C7H4ClIO

7,540

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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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

7,541

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

7,542

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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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

7,543

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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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

7,544

2-Chloro-4-(methylsulfonyl)benzoic Acid 98.0+%, TCI America™

CAS: 53250-83-2 Molecular Formula: C8H6ClO4S Molecular Weight (g/mol): 233.64 MDL Number: MFCD00216496 InChI Key: CTTWSFIIFMWHLQ-UHFFFAOYSA-M Synonym: 2-chloro-4-methylsulfonyl benzoic acid,2-chloro-4-methylsulphonylbenzoic acid,2-chloro-4-methanesulfonylbenzoic acid,benzoic acid, 2-chloro-4-methylsulfonyl,2-chloro-4-methanesulfonyl-benzoic acid,2-chloro-4-methylsulfonyl benzoic acid dry basis,maybridge1_004133,cmba,pubchem20281,acmc-1aupa PubChem CID: 735863 IUPAC Name: 2-chloro-4-methanesulfonylbenzoate SMILES: CS(=O)(=O)C1=CC=C(C([O-])=O)C(Cl)=C1

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Specifications

PubChem CID	735863
CAS	53250-83-2
Molecular Weight (g/mol)	233.64
MDL Number	MFCD00216496
SMILES	CS(=O)(=O)C1=CC=C(C([O-])=O)C(Cl)=C1
Synonym	2-chloro-4-methylsulfonyl benzoic acid,2-chloro-4-methylsulphonylbenzoic acid,2-chloro-4-methanesulfonylbenzoic acid,benzoic acid, 2-chloro-4-methylsulfonyl,2-chloro-4-methanesulfonyl-benzoic acid,2-chloro-4-methylsulfonyl benzoic acid dry basis,maybridge1_004133,cmba,pubchem20281,acmc-1aupa
IUPAC Name	2-chloro-4-methanesulfonylbenzoate
InChI Key	CTTWSFIIFMWHLQ-UHFFFAOYSA-M
Molecular Formula	C8H6ClO4S

7,545

Ethyl 4-Bromobenzoate 98.0+%, TCI America™

CAS: 5798-75-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00016329 InChI Key: XZIAFENWXIQIKR-UHFFFAOYSA-N Synonym: 4-bromobenzoic acid ethyl ester,ethyl p-bromobenzoate,benzoic acid, 4-bromo-, ethyl ester,ethyl4-bromobenzoate,ethyl-4-bromobenzoate,p-ethoxycarbonyl phenyl bromide,benzoic acid, p-bromo-, ethyl ester,4-bromo-benzoic acid ethyl ester,4-bromobenzoic acid, ethyl ester,ethyl-p-bromobenzoate PubChem CID: 22043 IUPAC Name: ethyl 4-bromobenzoate SMILES: CCOC(=O)C1=CC=C(Br)C=C1

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Specifications

PubChem CID	22043
CAS	5798-75-4
Molecular Weight (g/mol)	229.07
MDL Number	MFCD00016329
SMILES	CCOC(=O)C1=CC=C(Br)C=C1
Synonym	4-bromobenzoic acid ethyl ester,ethyl p-bromobenzoate,benzoic acid, 4-bromo-, ethyl ester,ethyl4-bromobenzoate,ethyl-4-bromobenzoate,p-ethoxycarbonyl phenyl bromide,benzoic acid, p-bromo-, ethyl ester,4-bromo-benzoic acid ethyl ester,4-bromobenzoic acid, ethyl ester,ethyl-p-bromobenzoate
IUPAC Name	ethyl 4-bromobenzoate
InChI Key	XZIAFENWXIQIKR-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

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