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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5,791 – 5,805 of 119,425 results

5,791

Pentafluoroanisole 98.0+%, TCI America™

CAS: 389-40-2 Molecular Formula: C7H3F5O Molecular Weight (g/mol): 198.092 MDL Number: MFCD00000289 InChI Key: ZRQUIRABLIQJRI-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluoroanisole,pentafluoroanisole,benzene, pentafluoromethoxy,pentafluorophenyl methyl ether,pentafluoromethoxybenzene,methyl pentafluorophenyl ether,benzene, 1,2,3,4,5-pentafluoro-6-methoxy,anisole, 2,3,4,5,6-pentafluoro,1,2,3,4,6-pentafluoro-5-methoxybenzene,methoxypentafluorobenzene PubChem CID: 67849 IUPAC Name: 1,2,3,4,5-pentafluoro-6-methoxybenzene SMILES: COC1=C(C(=C(C(=C1F)F)F)F)F

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PubChem CID	67849
CAS	389-40-2
Molecular Weight (g/mol)	198.092
MDL Number	MFCD00000289
SMILES	COC1=C(C(=C(C(=C1F)F)F)F)F
Synonym	2,3,4,5,6-pentafluoroanisole,pentafluoroanisole,benzene, pentafluoromethoxy,pentafluorophenyl methyl ether,pentafluoromethoxybenzene,methyl pentafluorophenyl ether,benzene, 1,2,3,4,5-pentafluoro-6-methoxy,anisole, 2,3,4,5,6-pentafluoro,1,2,3,4,6-pentafluoro-5-methoxybenzene,methoxypentafluorobenzene
IUPAC Name	1,2,3,4,5-pentafluoro-6-methoxybenzene
InChI Key	ZRQUIRABLIQJRI-UHFFFAOYSA-N
Molecular Formula	C7H3F5O

5,792

Isovanillyl Alcohol 98.0+%, TCI America™

CAS: 4383-06-6 Molecular Formula: C8H10O3 Molecular Weight (g/mol): 154.17 InChI Key: WHKRHBLAJFYZKF-UHFFFAOYSA-N Synonym: 3-hydroxy-4-methoxybenzyl alcohol,5-hydroxymethyl-2-methoxyphenol,isovanillyl alcohol,3-hydroxy-4-methoxybenzylalcohol,benzenemethanol, 3-hydroxy-4-methoxy,4-methoxy-3-hydroxy benzyl alcohol,pubchem15050,ksc495i5l,3-hydroxy-4-methoxy-benzyl alcohol,3-hydroxy-4-methoxy benzyl alcohol PubChem CID: 78089 IUPAC Name: 5-(hydroxymethyl)-2-methoxyphenol SMILES: COC1=C(C=C(C=C1)CO)O

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PubChem CID	78089
CAS	4383-06-6
Molecular Weight (g/mol)	154.17
SMILES	COC1=C(C=C(C=C1)CO)O
Synonym	3-hydroxy-4-methoxybenzyl alcohol,5-hydroxymethyl-2-methoxyphenol,isovanillyl alcohol,3-hydroxy-4-methoxybenzylalcohol,benzenemethanol, 3-hydroxy-4-methoxy,4-methoxy-3-hydroxy benzyl alcohol,pubchem15050,ksc495i5l,3-hydroxy-4-methoxy-benzyl alcohol,3-hydroxy-4-methoxy benzyl alcohol
IUPAC Name	5-(hydroxymethyl)-2-methoxyphenol
InChI Key	WHKRHBLAJFYZKF-UHFFFAOYSA-N
Molecular Formula	C8H10O3

5,793

3-Methoxybenzyl Chloride 96.0+%, TCI America™

CAS: 824-98-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00000907 InChI Key: VGISFWWEOGVMED-UHFFFAOYSA-N Synonym: 3-methoxybenzyl chloride,1-chloromethyl-3-methoxybenzene,m-methoxybenzyl chloride,m-chloromethyl anisole,benzene, 1-chloromethyl-3-methoxy,anisole, m-chloromethyl,3-methoxybenzylchloride,3-chloromethyl anisole,3-methoxy benzyl chloride,benzyl chloride,3-methoxy PubChem CID: 69994 IUPAC Name: 1-(chloromethyl)-3-methoxybenzene SMILES: COC1=CC=CC(CCl)=C1

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Specifications

PubChem CID	69994
CAS	824-98-6
Molecular Weight (g/mol)	156.61
MDL Number	MFCD00000907
SMILES	COC1=CC=CC(CCl)=C1
Synonym	3-methoxybenzyl chloride,1-chloromethyl-3-methoxybenzene,m-methoxybenzyl chloride,m-chloromethyl anisole,benzene, 1-chloromethyl-3-methoxy,anisole, m-chloromethyl,3-methoxybenzylchloride,3-chloromethyl anisole,3-methoxy benzyl chloride,benzyl chloride,3-methoxy
IUPAC Name	1-(chloromethyl)-3-methoxybenzene
InChI Key	VGISFWWEOGVMED-UHFFFAOYSA-N
Molecular Formula	C8H9ClO

5,794

(R)-4-Benzyloxymethyl-2,2-dimethyl-1,3-dioxolane 97.0+%, TCI America™

CAS: 14347-83-2 Molecular Formula: C13H18O3 Molecular Weight (g/mol): 222.284 MDL Number: MFCD00066533 InChI Key: DBFDSKSLTCMIPB-GFCCVEGCSA-N PubChem CID: 10944055 IUPAC Name: (4R)-2,2-dimethyl-4-(phenylmethoxymethyl)-1,3-dioxolane SMILES: CC1(OCC(O1)COCC2=CC=CC=C2)C

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Specifications

PubChem CID	10944055
CAS	14347-83-2
Molecular Weight (g/mol)	222.284
MDL Number	MFCD00066533
SMILES	CC1(OCC(O1)COCC2=CC=CC=C2)C
IUPAC Name	(4R)-2,2-dimethyl-4-(phenylmethoxymethyl)-1,3-dioxolane
InChI Key	DBFDSKSLTCMIPB-GFCCVEGCSA-N
Molecular Formula	C13H18O3

5,795

2-Bromo-1,3-bis(bromomethyl)benzene 98.0+%, TCI America™

CAS: 25006-88-6 Molecular Formula: C8H7Br3 Molecular Weight (g/mol): 342.86 MDL Number: MFCD00229246 InChI Key: HSYMWXREIPJGHX-UHFFFAOYSA-N PubChem CID: 621912 IUPAC Name: 2-bromo-1,3-bis(bromomethyl)benzene SMILES: BrCC1=CC=CC(CBr)=C1Br

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Specifications

PubChem CID	621912
CAS	25006-88-6
Molecular Weight (g/mol)	342.86
MDL Number	MFCD00229246
SMILES	BrCC1=CC=CC(CBr)=C1Br
IUPAC Name	2-bromo-1,3-bis(bromomethyl)benzene
InChI Key	HSYMWXREIPJGHX-UHFFFAOYSA-N
Molecular Formula	C8H7Br3

5,796

alpha,alpha',2,3,5,6-Hexachloro-p-xylene 98.0+%, TCI America™

CAS: 1079-17-0 Molecular Formula: C8H4Cl6 Molecular Weight (g/mol): 312.82 MDL Number: MFCD00000894 InChI Key: IYGDLOMSJZQSGY-UHFFFAOYSA-N PubChem CID: 66179 IUPAC Name: 1,2,4,5-tetrachloro-3,6-bis(chloromethyl)benzene SMILES: C(C1=C(C(=C(C(=C1Cl)Cl)CCl)Cl)Cl)Cl

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Specifications

PubChem CID	66179
CAS	1079-17-0
Molecular Weight (g/mol)	312.82
MDL Number	MFCD00000894
SMILES	C(C1=C(C(=C(C(=C1Cl)Cl)CCl)Cl)Cl)Cl
IUPAC Name	1,2,4,5-tetrachloro-3,6-bis(chloromethyl)benzene
InChI Key	IYGDLOMSJZQSGY-UHFFFAOYSA-N
Molecular Formula	C8H4Cl6

5,797

4-(Ethoxymethyl)-2-methoxyphenol 98.0+%, TCI America™

CAS: 13184-86-6 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.219 MDL Number: MFCD06409999 InChI Key: KOCVACNWDMSLBM-UHFFFAOYSA-N Synonym: Ethyl Vanillyl Ether PubChem CID: 61586 IUPAC Name: 4-(ethoxymethyl)-2-methoxyphenol SMILES: CCOCC1=CC(=C(C=C1)O)OC

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Specifications

PubChem CID	61586
CAS	13184-86-6
Molecular Weight (g/mol)	182.219
MDL Number	MFCD06409999
SMILES	CCOCC1=CC(=C(C=C1)O)OC
Synonym	Ethyl Vanillyl Ether
IUPAC Name	4-(ethoxymethyl)-2-methoxyphenol
InChI Key	KOCVACNWDMSLBM-UHFFFAOYSA-N
Molecular Formula	C10H14O3

5,798

Methyl 3-(Bromomethyl)benzoate 97.0+%, TCI America™

CAS: 1129-28-8 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00051437 InChI Key: YUHSMQQNPRLEEJ-UHFFFAOYSA-N PubChem CID: 517981 IUPAC Name: methyl 3-(bromomethyl)benzoate SMILES: COC(=O)C1=CC=CC(CBr)=C1

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Specifications

PubChem CID	517981
CAS	1129-28-8
Molecular Weight (g/mol)	229.07
MDL Number	MFCD00051437
SMILES	COC(=O)C1=CC=CC(CBr)=C1
IUPAC Name	methyl 3-(bromomethyl)benzoate
InChI Key	YUHSMQQNPRLEEJ-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

5,799

4-Chloro-3-nitrobenzyl Alcohol 98.0+%, TCI America™

CAS: 55912-20-4 Molecular Formula: C7H6ClNO3 Molecular Weight (g/mol): 187.579 MDL Number: MFCD00007086 InChI Key: QLLRQJDSYJIXTN-UHFFFAOYSA-N PubChem CID: 91933 IUPAC Name: (4-chloro-3-nitrophenyl)methanol SMILES: C1=CC(=C(C=C1CO)[N+](=O)[O-])Cl

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Specifications

PubChem CID	91933
CAS	55912-20-4
Molecular Weight (g/mol)	187.579
MDL Number	MFCD00007086
SMILES	C1=CC(=C(C=C1CO)[N+](=O)[O-])Cl
IUPAC Name	(4-chloro-3-nitrophenyl)methanol
InChI Key	QLLRQJDSYJIXTN-UHFFFAOYSA-N
Molecular Formula	C7H6ClNO3

5,800

2,3,4,6-Tetrafluorobenzyl Alcohol 98.0+%, TCI America™

CAS: 53001-70-0 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.10 MDL Number: MFCD03701105 InChI Key: BXLQTYVTBJQPPZ-UHFFFAOYSA-N PubChem CID: 17750859 IUPAC Name: (2,3,4,6-tetrafluorophenyl)methanol SMILES: OCC1=C(F)C=C(F)C(F)=C1F

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Specifications

PubChem CID	17750859
CAS	53001-70-0
Molecular Weight (g/mol)	180.10
MDL Number	MFCD03701105
SMILES	OCC1=C(F)C=C(F)C(F)=C1F
IUPAC Name	(2,3,4,6-tetrafluorophenyl)methanol
InChI Key	BXLQTYVTBJQPPZ-UHFFFAOYSA-N
Molecular Formula	C7H4F4O

5,801

2,6-Difluorobenzyl Chloride 98.0+%, TCI America™

CAS: 697-73-4 Molecular Formula: C7H5ClF2 Molecular Weight (g/mol): 162.564 MDL Number: MFCD00191346 InChI Key: MJXRENZUAQXZGJ-UHFFFAOYSA-N PubChem CID: 581570 IUPAC Name: 2-(chloromethyl)-1,3-difluorobenzene SMILES: C1=CC(=C(C(=C1)F)CCl)F

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Specifications

PubChem CID	581570
CAS	697-73-4
Molecular Weight (g/mol)	162.564
MDL Number	MFCD00191346
SMILES	C1=CC(=C(C(=C1)F)CCl)F
IUPAC Name	2-(chloromethyl)-1,3-difluorobenzene
InChI Key	MJXRENZUAQXZGJ-UHFFFAOYSA-N
Molecular Formula	C7H5ClF2

5,802

4-Ethylbenzyl Chloride 98.0+%, TCI America™

CAS: 1467-05-6 Molecular Formula: C9H11Cl Molecular Weight (g/mol): 154.64 MDL Number: MFCD00039357 InChI Key: DUBCVXSYZVTCOC-UHFFFAOYSA-N Synonym: 4-ethylbenzyl chloride,1-chloromethyl-4-ethylbenzene,p-ethylbenzylchloride,p-ethylbenzyl chloride,benzene, 1-chloromethyl-4-ethyl,ethyxlbenzylchloride,4-ethylbenzylchloride,1-chloromethyl-4-ethyl-benzene,4-chloromethyl-1-ethylbenzene,4-ethylbenzyl chloride contains ca 2-form PubChem CID: 73843 IUPAC Name: 1-(chloromethyl)-4-ethylbenzene SMILES: CCC1=CC=C(CCl)C=C1

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Specifications

PubChem CID	73843
CAS	1467-05-6
Molecular Weight (g/mol)	154.64
MDL Number	MFCD00039357
SMILES	CCC1=CC=C(CCl)C=C1
Synonym	4-ethylbenzyl chloride,1-chloromethyl-4-ethylbenzene,p-ethylbenzylchloride,p-ethylbenzyl chloride,benzene, 1-chloromethyl-4-ethyl,ethyxlbenzylchloride,4-ethylbenzylchloride,1-chloromethyl-4-ethyl-benzene,4-chloromethyl-1-ethylbenzene,4-ethylbenzyl chloride contains ca 2-form
IUPAC Name	1-(chloromethyl)-4-ethylbenzene
InChI Key	DUBCVXSYZVTCOC-UHFFFAOYSA-N
Molecular Formula	C9H11Cl

5,803

2-Bromo-5-methoxybenzyl Bromide 98.0+%, TCI America™

CAS: 19614-12-1 Molecular Formula: C8H8Br2O Molecular Weight (g/mol): 279.959 MDL Number: MFCD00078664 InChI Key: MURVUTUZSUEIGI-UHFFFAOYSA-N Synonym: 2-bromo-5-methoxybenzyl bromide,1-bromo-2-bromomethyl-4-methoxybenzene,2-bromo-5-methoxybenzylbromide,4-bromo-3-bromomethyl anisole,2-bromo-5-methoxy-benzyl bromide,benzene, 1-bromo-2-bromomethyl-4-methoxy,4-bromo-3-bromomethyl-1-methoxybenzene,pubchem18176,acmc-20a5x2,4-bromo3-bromomethylanisole PubChem CID: 3525951 IUPAC Name: 1-bromo-2-(bromomethyl)-4-methoxybenzene SMILES: COC1=CC(=C(C=C1)Br)CBr

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Specifications

PubChem CID	3525951
CAS	19614-12-1
Molecular Weight (g/mol)	279.959
MDL Number	MFCD00078664
SMILES	COC1=CC(=C(C=C1)Br)CBr
Synonym	2-bromo-5-methoxybenzyl bromide,1-bromo-2-bromomethyl-4-methoxybenzene,2-bromo-5-methoxybenzylbromide,4-bromo-3-bromomethyl anisole,2-bromo-5-methoxy-benzyl bromide,benzene, 1-bromo-2-bromomethyl-4-methoxy,4-bromo-3-bromomethyl-1-methoxybenzene,pubchem18176,acmc-20a5x2,4-bromo3-bromomethylanisole
IUPAC Name	1-bromo-2-(bromomethyl)-4-methoxybenzene
InChI Key	MURVUTUZSUEIGI-UHFFFAOYSA-N
Molecular Formula	C8H8Br2O

5,804

2-(Bromomethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™

CAS: 91983-14-1 Molecular Formula: C7H8BBrO2 Molecular Weight (g/mol): 214.85 MDL Number: MFCD01318941 InChI Key: MYVJCOQGXCONPE-UHFFFAOYSA-N Synonym: 2-bromomethylphenylboronic acid,2-bromomethyl benzeneboronic acid,2-bromomethyl phenylboronic acid,2-bromomethyl phenyl boronic acid,2-bromomethylphenylboronicacid,2-boronobenzyl bromide,o-boronobenzyl bromide,2-bromomethylphenyl boronic acid,pubchem7781 PubChem CID: 2773278 IUPAC Name: [2-(bromomethyl)phenyl]boronic acid SMILES: OB(O)C1=CC=CC=C1CBr

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Specifications

PubChem CID	2773278
CAS	91983-14-1
Molecular Weight (g/mol)	214.85
MDL Number	MFCD01318941
SMILES	OB(O)C1=CC=CC=C1CBr
Synonym	2-bromomethylphenylboronic acid,2-bromomethyl benzeneboronic acid,2-bromomethyl phenylboronic acid,2-bromomethyl phenyl boronic acid,2-bromomethylphenylboronicacid,2-boronobenzyl bromide,o-boronobenzyl bromide,2-bromomethylphenyl boronic acid,pubchem7781
IUPAC Name	[2-(bromomethyl)phenyl]boronic acid
InChI Key	MYVJCOQGXCONPE-UHFFFAOYSA-N
Molecular Formula	C7H8BBrO2

5,805

2,3-Difluorophenylacetonitrile 98.0+%, TCI America™

CAS: 145689-34-5 Molecular Formula: C8H5F2N Molecular Weight (g/mol): 153.13 MDL Number: MFCD00061277 InChI Key: IYRCHGRRMKOSHW-UHFFFAOYSA-N Synonym: 2,3-difluorophenylacetonitrile,2-2,3-difluorophenyl acetonitrile,2,3-difluorobenzyl cyanide,2,3-difluorophenylacetanitrile,benzeneacetonitrile, 2,3-difluoro,2-2,3-difluorophenyl ethanenitrile,2,3-difluorobenzeneacetonitrile,pubchem1587,acmc-209x0i,ksc183q4t PubChem CID: 518968 IUPAC Name: 2-(2,3-difluorophenyl)acetonitrile SMILES: FC1=CC=CC(CC#N)=C1F

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Specifications

PubChem CID	518968
CAS	145689-34-5
Molecular Weight (g/mol)	153.13
MDL Number	MFCD00061277
SMILES	FC1=CC=CC(CC#N)=C1F
Synonym	2,3-difluorophenylacetonitrile,2-2,3-difluorophenyl acetonitrile,2,3-difluorobenzyl cyanide,2,3-difluorophenylacetanitrile,benzeneacetonitrile, 2,3-difluoro,2-2,3-difluorophenyl ethanenitrile,2,3-difluorobenzeneacetonitrile,pubchem1587,acmc-209x0i,ksc183q4t
IUPAC Name	2-(2,3-difluorophenyl)acetonitrile
InChI Key	IYRCHGRRMKOSHW-UHFFFAOYSA-N
Molecular Formula	C8H5F2N

Benzene and substituted derivatives

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