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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6,766 – 6,780 of 57,364 results

6,766

Sodium Phenoxyacetate 98.0+%, TCI America™

CAS: 3598-16-1 Molecular Formula: C8H7NaO3 Molecular Weight (g/mol): 174.13 MDL Number: MFCD00064234 InChI Key: WPTJBFNYRRZIDZ-UHFFFAOYSA-M Synonym: Phenoxyacetic Acid Sodium Salt PubChem CID: 23687423 IUPAC Name: sodium 2-phenoxyacetate SMILES: [Na+].[O-]C(=O)COC1=CC=CC=C1

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Specifications

PubChem CID	23687423
CAS	3598-16-1
Molecular Weight (g/mol)	174.13
MDL Number	MFCD00064234
SMILES	[Na+].[O-]C(=O)COC1=CC=CC=C1
Synonym	Phenoxyacetic Acid Sodium Salt
IUPAC Name	sodium 2-phenoxyacetate
InChI Key	WPTJBFNYRRZIDZ-UHFFFAOYSA-M
Molecular Formula	C8H7NaO3

6,767

4-Iodophenoxyacetic Acid 97.0+%, TCI America™

CAS: 1878-94-0 Molecular Formula: C8H7IO3 Molecular Weight (g/mol): 278.045 InChI Key: RKORKXFKXYYHAQ-UHFFFAOYSA-N Synonym: 4-iodophenoxyacetic acid,2-4-iodophenoxy acetic acid,4-iodophenoxy acetic acid,p-iodophenoxyacetic acid,p-iodophenoxy acetic acid,acetic acid, 4-iodophenoxy,4-iodophenoxyacetic,4-iodophenoxyaceticacide,acmc-209eqm,4-iodo phenoxyacetic acid PubChem CID: 74658 IUPAC Name: 2-(4-iodophenoxy)acetic acid SMILES: C1=CC(=CC=C1OCC(=O)O)I

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Specifications

PubChem CID	74658
CAS	1878-94-0
Molecular Weight (g/mol)	278.045
SMILES	C1=CC(=CC=C1OCC(=O)O)I
Synonym	4-iodophenoxyacetic acid,2-4-iodophenoxy acetic acid,4-iodophenoxy acetic acid,p-iodophenoxyacetic acid,p-iodophenoxy acetic acid,acetic acid, 4-iodophenoxy,4-iodophenoxyacetic,4-iodophenoxyaceticacide,acmc-209eqm,4-iodo phenoxyacetic acid
IUPAC Name	2-(4-iodophenoxy)acetic acid
InChI Key	RKORKXFKXYYHAQ-UHFFFAOYSA-N
Molecular Formula	C8H7IO3

6,768

1-Naphthyloxyacetic Acid 98.0+%, TCI America™

CAS: 2976-75-2 Molecular Formula: C12H10O3 Molecular Weight (g/mol): 202.209 MDL Number: MFCD00003927 InChI Key: GHRYSOFWKRRLMI-UHFFFAOYSA-N Synonym: 1-naphthoxyacetic acid,1-naphthyloxy acetic acid,2-naphthalen-1-yloxy acetic acid,1-naphthyloxyacetic acid,naphthyloxyacetic acid,2-1-naphthyloxy acetic acid,unii-9qi2464poa,1-naphthoxy acetic acid,naphthalen-1-yloxy acetic acid,acetic acid, 1-naphthalenyloxy PubChem CID: 76313 ChEBI: CHEBI:44588 IUPAC Name: 2-naphthalen-1-yloxyacetic acid SMILES: C1=CC=C2C(=C1)C=CC=C2OCC(=O)O

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Specifications

PubChem CID	76313
CAS	2976-75-2
Molecular Weight (g/mol)	202.209
ChEBI	CHEBI:44588
MDL Number	MFCD00003927
SMILES	C1=CC=C2C(=C1)C=CC=C2OCC(=O)O
Synonym	1-naphthoxyacetic acid,1-naphthyloxy acetic acid,2-naphthalen-1-yloxy acetic acid,1-naphthyloxyacetic acid,naphthyloxyacetic acid,2-1-naphthyloxy acetic acid,unii-9qi2464poa,1-naphthoxy acetic acid,naphthalen-1-yloxy acetic acid,acetic acid, 1-naphthalenyloxy
IUPAC Name	2-naphthalen-1-yloxyacetic acid
InChI Key	GHRYSOFWKRRLMI-UHFFFAOYSA-N
Molecular Formula	C12H10O3

6,769

4-Bromophenoxyacetic Acid 98.0+%, TCI America™

CAS: 1878-91-7 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.045 InChI Key: SZEBGAQWWSUOHT-UHFFFAOYSA-N Synonym: 4-bromophenoxyacetic acid,2-4-bromophenoxy acetic acid,4-bromophenoxy acetic acid,p-bromophenoxyacetic acid,acetic acid, 4-bromophenoxy,p-bromophenoxyacetate,p-bromophenoxyacetic acvid,acetic acid, 2-4-bromophenoxy,acetic acid, p-bromophenoxy PubChem CID: 74657 IUPAC Name: 2-(4-bromophenoxy)acetic acid SMILES: C1=CC(=CC=C1OCC(=O)O)Br

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Specifications

PubChem CID	74657
CAS	1878-91-7
Molecular Weight (g/mol)	231.045
SMILES	C1=CC(=CC=C1OCC(=O)O)Br
Synonym	4-bromophenoxyacetic acid,2-4-bromophenoxy acetic acid,4-bromophenoxy acetic acid,p-bromophenoxyacetic acid,acetic acid, 4-bromophenoxy,p-bromophenoxyacetate,p-bromophenoxyacetic acvid,acetic acid, 2-4-bromophenoxy,acetic acid, p-bromophenoxy
IUPAC Name	2-(4-bromophenoxy)acetic acid
InChI Key	SZEBGAQWWSUOHT-UHFFFAOYSA-N
Molecular Formula	C8H7BrO3

6,770

2-Naphthyloxyacetic Acid 98.0+%, TCI America™

CAS: 120-23-0 Molecular Formula: C12H10O3 Molecular Weight (g/mol): 202.209 MDL Number: MFCD00004066 InChI Key: RZCJYMOBWVJQGV-UHFFFAOYSA-N Synonym: 2-naphthoxyacetic acid,2-naphthyloxy acetic acid,bnoa,2-naphthyloxyacetic acid,2-naphthalen-2-yloxy acetic acid,noxa,betoxon,2-noxa,naphthoxyacetic acid,betapal PubChem CID: 8422 ChEBI: CHEBI:50397 IUPAC Name: 2-naphthalen-2-yloxyacetic acid SMILES: C1=CC=C2C=C(C=CC2=C1)OCC(=O)O

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Specifications

PubChem CID	8422
CAS	120-23-0
Molecular Weight (g/mol)	202.209
ChEBI	CHEBI:50397
MDL Number	MFCD00004066
SMILES	C1=CC=C2C=C(C=CC2=C1)OCC(=O)O
Synonym	2-naphthoxyacetic acid,2-naphthyloxy acetic acid,bnoa,2-naphthyloxyacetic acid,2-naphthalen-2-yloxy acetic acid,noxa,betoxon,2-noxa,naphthoxyacetic acid,betapal
IUPAC Name	2-naphthalen-2-yloxyacetic acid
InChI Key	RZCJYMOBWVJQGV-UHFFFAOYSA-N
Molecular Formula	C12H10O3

6,771

(2-Carbamoylphenoxy)acetic Acid 99.0+%, TCI America™

CAS: 25395-22-6 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.17 MDL Number: MFCD00025472 InChI Key: RLISWLLILOTWGG-UHFFFAOYSA-N Synonym: 2-(Carboxymethoxy)benzamide, Salicylamide O-Acetic Acid PubChem CID: 93086 IUPAC Name: 2-(2-carbamoylphenoxy)acetic acid SMILES: NC(=O)C1=CC=CC=C1OCC(O)=O

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Specifications

PubChem CID	93086
CAS	25395-22-6
Molecular Weight (g/mol)	195.17
MDL Number	MFCD00025472
SMILES	NC(=O)C1=CC=CC=C1OCC(O)=O
Synonym	2-(Carboxymethoxy)benzamide, Salicylamide O-Acetic Acid
IUPAC Name	2-(2-carbamoylphenoxy)acetic acid
InChI Key	RLISWLLILOTWGG-UHFFFAOYSA-N
Molecular Formula	C9H9NO4

6,772

4-(Hydroxymethyl)phenoxyacetic Acid 98.0+%, TCI America™

CAS: 68858-21-9 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00057827 InChI Key: VUCNQOPCYRJCGQ-UHFFFAOYSA-N Synonym: 4-hydroxymethyl phenoxyacetic acid,4-hydroxymethylphenoxyacetic acid,2-4-hydroxymethyl phenoxy acetic acid,hmp linker,p-hydroxymethyl phenoxyacetic acid,4-hydroxymethyl-phenoxy acetic acid PubChem CID: 194291 IUPAC Name: 2-[4-(hydroxymethyl)phenoxy]acetic acid SMILES: C1=CC(=CC=C1CO)OCC(=O)O

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Specifications

PubChem CID	194291
CAS	68858-21-9
Molecular Weight (g/mol)	182.175
MDL Number	MFCD00057827
SMILES	C1=CC(=CC=C1CO)OCC(=O)O
Synonym	4-hydroxymethyl phenoxyacetic acid,4-hydroxymethylphenoxyacetic acid,2-4-hydroxymethyl phenoxy acetic acid,hmp linker,p-hydroxymethyl phenoxyacetic acid,4-hydroxymethyl-phenoxy acetic acid
IUPAC Name	2-[4-(hydroxymethyl)phenoxy]acetic acid
InChI Key	VUCNQOPCYRJCGQ-UHFFFAOYSA-N
Molecular Formula	C9H10O4

6,773

2-Iodobenzyl Alcohol 98.0+%, TCI America™

CAS: 5159-41-1 Molecular Formula: C7H7IO Molecular Weight (g/mol): 234.036 MDL Number: MFCD00004610 InChI Key: WZCXOBMFBKSSFA-UHFFFAOYSA-N Synonym: 2-iodobenzyl alcohol,2-iodophenyl methanol,o-iodobenzyl alcohol,2-iodobenzylalcohol,benzenemethanol, 2-iodo,2-iodobenzylic alcohol,2-jod-benzylalkohol,o-iodo benzylalcohol,2-iodo-benzyl alcohol PubChem CID: 107629 IUPAC Name: (2-iodophenyl)methanol SMILES: C1=CC=C(C(=C1)CO)I

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Specifications

PubChem CID	107629
CAS	5159-41-1
Molecular Weight (g/mol)	234.036
MDL Number	MFCD00004610
SMILES	C1=CC=C(C(=C1)CO)I
Synonym	2-iodobenzyl alcohol,2-iodophenyl methanol,o-iodobenzyl alcohol,2-iodobenzylalcohol,benzenemethanol, 2-iodo,2-iodobenzylic alcohol,2-jod-benzylalkohol,o-iodo benzylalcohol,2-iodo-benzyl alcohol
IUPAC Name	(2-iodophenyl)methanol
InChI Key	WZCXOBMFBKSSFA-UHFFFAOYSA-N
Molecular Formula	C7H7IO

6,774

4-Bromobenzaldehyde Diethyl Acetal 97.0+%, TCI America™

CAS: 34421-94-8 Molecular Formula: C11H15BrO2 Molecular Weight (g/mol): 259.14 MDL Number: MFCD01863514 InChI Key: BFSNEBVTOODGHZ-UHFFFAOYSA-N Synonym: 4-bromobenzaldehyde diethyl acetal,1-bromo-4-diethoxymethyl benzene,4-bromobenzaldehydediethylacetal,benzene, 1-bromo-4-diethoxymethyl,4-bromophenyl diethoxymethane,4-bromobenzaldehyde diethylacetal,4-bromo-alpha,alpha-diethoxytoluene,pubchem5372,acmc-1aigt,4-bromobenzaldehydediethyl acetal PubChem CID: 688340 IUPAC Name: 1-bromo-4-(diethoxymethyl)benzene SMILES: CCOC(OCC)C1=CC=C(Br)C=C1

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Specifications

PubChem CID	688340
CAS	34421-94-8
Molecular Weight (g/mol)	259.14
MDL Number	MFCD01863514
SMILES	CCOC(OCC)C1=CC=C(Br)C=C1
Synonym	4-bromobenzaldehyde diethyl acetal,1-bromo-4-diethoxymethyl benzene,4-bromobenzaldehydediethylacetal,benzene, 1-bromo-4-diethoxymethyl,4-bromophenyl diethoxymethane,4-bromobenzaldehyde diethylacetal,4-bromo-alpha,alpha-diethoxytoluene,pubchem5372,acmc-1aigt,4-bromobenzaldehydediethyl acetal
IUPAC Name	1-bromo-4-(diethoxymethyl)benzene
InChI Key	BFSNEBVTOODGHZ-UHFFFAOYSA-N
Molecular Formula	C11H15BrO2

6,775

3-Fluoro-4-methoxybenzyl Chloride 98.0+%, TCI America™

CAS: 351-52-0 Molecular Formula: C8H8ClFO Molecular Weight (g/mol): 174.60 MDL Number: MFCD04973773 InChI Key: DDAXEANMRGIVDY-UHFFFAOYSA-N Synonym: 3-fluoro-4-methoxybenzyl chloride,4-chloromethyl-2-fluoro-1-methoxybenzene,3-fluoro-4-methoxybenzylchloride,benzene,4-chloromethyl-2-fluoro-1-methoxy,benzene, 4-chloromethyl-2-fluoro-1-methoxy,4-chloromethyl-2-fluorophenyl methyl ether,4-chloromethyl-2-fluoro-1-methoxy-benzene,3-fluor-4-methoxy-benzylchlorid,4-chloromethyl-2-fluoroanisole,3-fluoro-4-methoxy benzyl chloride PubChem CID: 2060903 IUPAC Name: 4-(chloromethyl)-2-fluoro-1-methoxybenzene SMILES: COC1=CC=C(CCl)C=C1F

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Specifications

PubChem CID	2060903
CAS	351-52-0
Molecular Weight (g/mol)	174.60
MDL Number	MFCD04973773
SMILES	COC1=CC=C(CCl)C=C1F
Synonym	3-fluoro-4-methoxybenzyl chloride,4-chloromethyl-2-fluoro-1-methoxybenzene,3-fluoro-4-methoxybenzylchloride,benzene,4-chloromethyl-2-fluoro-1-methoxy,benzene, 4-chloromethyl-2-fluoro-1-methoxy,4-chloromethyl-2-fluorophenyl methyl ether,4-chloromethyl-2-fluoro-1-methoxy-benzene,3-fluor-4-methoxy-benzylchlorid,4-chloromethyl-2-fluoroanisole,3-fluoro-4-methoxy benzyl chloride
IUPAC Name	4-(chloromethyl)-2-fluoro-1-methoxybenzene
InChI Key	DDAXEANMRGIVDY-UHFFFAOYSA-N
Molecular Formula	C8H8ClFO

6,776

3,5-Bis[3,5-bis(3,5-dimethoxybenzyloxy)benzyloxy]benzyl Bromide 97.0+%, TCI America™

CAS: 152811-37-5 Molecular Formula: C57H59BrO14 Molecular Weight (g/mol): 1047.989 InChI Key: BMISSUNAKMQTFS-UHFFFAOYSA-N PubChem CID: 15891038 IUPAC Name: 1,3-bis[[3,5-bis[(3,5-dimethoxyphenyl)methoxy]phenyl]methoxy]-5-(bromomethyl)benzene SMILES: COC1=CC(=CC(=C1)COC2=CC(=CC(=C2)COC3=CC(=CC(=C3)CBr)OCC4=CC(=CC(=C4)OCC5=CC(=CC(=C5)OC)OC)OCC6=CC(=CC(=C6)OC)OC)OCC7=CC(=CC(=C7)OC)OC)OC

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Specifications

PubChem CID	15891038
CAS	152811-37-5
Molecular Weight (g/mol)	1047.989
SMILES	COC1=CC(=CC(=C1)COC2=CC(=CC(=C2)COC3=CC(=CC(=C3)CBr)OCC4=CC(=CC(=C4)OCC5=CC(=CC(=C5)OC)OC)OCC6=CC(=CC(=C6)OC)OC)OCC7=CC(=CC(=C7)OC)OC)OC
IUPAC Name	1,3-bis[[3,5-bis[(3,5-dimethoxyphenyl)methoxy]phenyl]methoxy]-5-(bromomethyl)benzene
InChI Key	BMISSUNAKMQTFS-UHFFFAOYSA-N
Molecular Formula	C57H59BrO14

6,777

2-Aminobenzyl Alcohol 98.0+%, TCI America™

CAS: 5344-90-1 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00007749 InChI Key: VYFOAVADNIHPTR-UHFFFAOYSA-N Synonym: 2-aminobenzyl alcohol,2-aminophenyl methanol,2-aminobenzylalcohol,o-aminobenzyl alcohol,2-aminobenzenemethanol,benzenemethanol, 2-amino,o-aminobenzylic alcohol,o-hydroxymethyl aniline,benzyl alcohol, o-amino,2-hydroxymethylaniline PubChem CID: 21439 IUPAC Name: (2-aminophenyl)methanol SMILES: C1=CC=C(C(=C1)CO)N

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Specifications

PubChem CID	21439
CAS	5344-90-1
Molecular Weight (g/mol)	123.155
MDL Number	MFCD00007749
SMILES	C1=CC=C(C(=C1)CO)N
Synonym	2-aminobenzyl alcohol,2-aminophenyl methanol,2-aminobenzylalcohol,o-aminobenzyl alcohol,2-aminobenzenemethanol,benzenemethanol, 2-amino,o-aminobenzylic alcohol,o-hydroxymethyl aniline,benzyl alcohol, o-amino,2-hydroxymethylaniline
IUPAC Name	(2-aminophenyl)methanol
InChI Key	VYFOAVADNIHPTR-UHFFFAOYSA-N
Molecular Formula	C7H9NO

6,778

4-(Bromomethyl)benzenesulfonyl Chloride 95.0+%, TCI America™

CAS: 66176-39-4 Molecular Formula: C7H6BrClO2S Molecular Weight (g/mol): 269.537 MDL Number: MFCD00156129 InChI Key: QXTQWYZHHMQSQH-UHFFFAOYSA-N Synonym: 4-bromomethyl benzenesulfonyl chloride,4-bromomethyl benzene-1-sulfonyl chloride,4-bromomethyl benzenesulfonylchloride,alpha-bromo-p-toluenesulphonyl chloride,alpha-bromo-p-toluenesulfonyl chloride,4-bromomethyl benzenesulphonyl chloride,4-bromomethyl benzene-1-sulfonylchloride,buttpark 94\04-08,4-bromomethyl phenyl chlorosulfone,4-bromomethylene benzenesulfonyl chloride PubChem CID: 2734409 IUPAC Name: 4-(bromomethyl)benzenesulfonyl chloride SMILES: C1=CC(=CC=C1CBr)S(=O)(=O)Cl

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Specifications

PubChem CID	2734409
CAS	66176-39-4
Molecular Weight (g/mol)	269.537
MDL Number	MFCD00156129
SMILES	C1=CC(=CC=C1CBr)S(=O)(=O)Cl
Synonym	4-bromomethyl benzenesulfonyl chloride,4-bromomethyl benzene-1-sulfonyl chloride,4-bromomethyl benzenesulfonylchloride,alpha-bromo-p-toluenesulphonyl chloride,alpha-bromo-p-toluenesulfonyl chloride,4-bromomethyl benzenesulphonyl chloride,4-bromomethyl benzene-1-sulfonylchloride,buttpark 94\04-08,4-bromomethyl phenyl chlorosulfone,4-bromomethylene benzenesulfonyl chloride
IUPAC Name	4-(bromomethyl)benzenesulfonyl chloride
InChI Key	QXTQWYZHHMQSQH-UHFFFAOYSA-N
Molecular Formula	C7H6BrClO2S

6,779

2,3,4-Trifluorobenzyl Bromide 98.0+%, TCI America™

CAS: 157911-55-2 Molecular Formula: C7H4BrF3 Molecular Weight (g/mol): 225.008 MDL Number: MFCD00061233 InChI Key: DGSXDQVPGXFOAN-UHFFFAOYSA-N PubChem CID: 2777050 IUPAC Name: 1-(bromomethyl)-2,3,4-trifluorobenzene SMILES: C1=CC(=C(C(=C1CBr)F)F)F

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Specifications

PubChem CID	2777050
CAS	157911-55-2
Molecular Weight (g/mol)	225.008
MDL Number	MFCD00061233
SMILES	C1=CC(=C(C(=C1CBr)F)F)F
IUPAC Name	1-(bromomethyl)-2,3,4-trifluorobenzene
InChI Key	DGSXDQVPGXFOAN-UHFFFAOYSA-N
Molecular Formula	C7H4BrF3

6,780

p-Xylylene Dithiocyanate 98.0+%, TCI America™

CAS: 1014-99-9 Molecular Formula: C10H8N2S2 Molecular Weight (g/mol): 220.308 InChI Key: ZMFLUYPLYCZQDR-UHFFFAOYSA-N PubChem CID: 4460705 IUPAC Name: [4-(thiocyanatomethyl)phenyl]methyl thiocyanate SMILES: C1=CC(=CC=C1CSC#N)CSC#N

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Specifications

PubChem CID	4460705
CAS	1014-99-9
Molecular Weight (g/mol)	220.308
SMILES	C1=CC(=CC=C1CSC#N)CSC#N
IUPAC Name	[4-(thiocyanatomethyl)phenyl]methyl thiocyanate
InChI Key	ZMFLUYPLYCZQDR-UHFFFAOYSA-N
Molecular Formula	C10H8N2S2

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Benzene and substituted derivatives

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