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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3,886 – 3,900 of 56,952 results

3,886

2-(Triphenylphosphoranylidene)propionaldehyde, 98%

CAS: 24720-64-7 Molecular Formula: C21H19OP Molecular Weight (g/mol): 318.36 MDL Number: MFCD00075596 InChI Key: VHUQEFAWBCDBSC-UHFFFAOYSA-N Synonym: 2-triphenylphosphoranylidene propionaldehyde,2-triphenylphosphoranylidene propanal,propanal, 2-triphenylphosphoranylidene,1-formylethylidenetriphenylphosphorane,2-triphenyl-??-phosphanylidene propanal,acmc-20aol9,2-triphenylylidene propanal,1-formylethylidene triphenyl phosphorane,alpha-formylethylidenetriphenylphosphorane,propanal,2-triphenylphosphoranylidene PubChem CID: 4280987 IUPAC Name: 2-(triphenyl-$l^{5}-phosphanylidene)propanal SMILES: CC(C=O)=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	4280987
CAS	24720-64-7
Molecular Weight (g/mol)	318.36
MDL Number	MFCD00075596
SMILES	CC(C=O)=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	2-triphenylphosphoranylidene propionaldehyde,2-triphenylphosphoranylidene propanal,propanal, 2-triphenylphosphoranylidene,1-formylethylidenetriphenylphosphorane,2-triphenyl-??-phosphanylidene propanal,acmc-20aol9,2-triphenylylidene propanal,1-formylethylidene triphenyl phosphorane,alpha-formylethylidenetriphenylphosphorane,propanal,2-triphenylphosphoranylidene
IUPAC Name	2-(triphenyl-$l^{5}-phosphanylidene)propanal
InChI Key	VHUQEFAWBCDBSC-UHFFFAOYSA-N
Molecular Formula	C21H19OP

3,887

p-Acetotoluidide, 99%

CAS: 103-89-9 Molecular Formula: C₉H₁₁NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00008677 InChI Key: YICAMJWHIUMFDI-UHFFFAOYSA-N Synonym: 4'-methylacetanilide,p-acetotoluidide,n-4-methylphenyl acetamide,4-methylacetanilide,n-acetyl-p-toluidine,p-acetotoluide,acetyl-p-toluidine,p-acetotoluidine,acetamide, n-4-methylphenyl,4-acetotoluide PubChem CID: 7684 IUPAC Name: N-(4-methylphenyl)acetamide SMILES: CC1=CC=C(C=C1)NC(=O)C

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Specifications

PubChem CID	7684
CAS	103-89-9
Molecular Weight (g/mol)	149.19
MDL Number	MFCD00008677
SMILES	CC1=CC=C(C=C1)NC(=O)C
Synonym	4'-methylacetanilide,p-acetotoluidide,n-4-methylphenyl acetamide,4-methylacetanilide,n-acetyl-p-toluidine,p-acetotoluide,acetyl-p-toluidine,p-acetotoluidine,acetamide, n-4-methylphenyl,4-acetotoluide
IUPAC Name	N-(4-methylphenyl)acetamide
InChI Key	YICAMJWHIUMFDI-UHFFFAOYSA-N
Molecular Formula	C₉H₁₁NO

3,888

4,4'-Dimethylbenzophenone, 98+%

CAS: 611-97-2 Molecular Formula: C₁₅H₁₄O Molecular Weight (g/mol): 210.28 MDL Number: MFCD00017214 InChI Key: ZWPWLKXZYNXATK-UHFFFAOYSA-N Synonym: 4,4'-dimethylbenzophenone,p-tolyl ketone,bis 4-methylphenyl methanone,di-p-tolyl ketone,methanone, bis 4-methylphenyl,p,p'-dimethylbenzophenone,p,p'-dimethyl di-phenyl ketone,bis-p-tolylmethanone,benzophenone, 4,4'-dimethyl,4,4-dimethylbenzophenone PubChem CID: 69148 IUPAC Name: bis(4-methylphenyl)methanone SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C

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Specifications

PubChem CID	69148
CAS	611-97-2
Molecular Weight (g/mol)	210.28
MDL Number	MFCD00017214
SMILES	CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C
Synonym	4,4'-dimethylbenzophenone,p-tolyl ketone,bis 4-methylphenyl methanone,di-p-tolyl ketone,methanone, bis 4-methylphenyl,p,p'-dimethylbenzophenone,p,p'-dimethyl di-phenyl ketone,bis-p-tolylmethanone,benzophenone, 4,4'-dimethyl,4,4-dimethylbenzophenone
IUPAC Name	bis(4-methylphenyl)methanone
InChI Key	ZWPWLKXZYNXATK-UHFFFAOYSA-N
Molecular Formula	C₁₅H₁₄O

3,889

4-Iodophenylhydrazine, 95%

CAS: 13116-27-3 Molecular Formula: C₆H₇IN₂ Molecular Weight (g/mol): 234.04 MDL Number: MFCD00052688 InChI Key: IQMLCMKMSBMMGR-UHFFFAOYSA-N Synonym: 4-iodophenyl hydrazine,1-4-iodophenyl hydrazine,4-iodo-phenyl-hydrazine,4-iodo phenyl hydrazine,p-iodophenyl-hydrazine,4-iodophenyl diazane,pubchem15797,acmc-1brf1,1-hydrazino-4-iodobenzene,4-iodophenylhydrazine PubChem CID: 704591 IUPAC Name: (4-iodophenyl)hydrazine SMILES: C1=CC(=CC=C1NN)I

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Specifications

PubChem CID	704591
CAS	13116-27-3
Molecular Weight (g/mol)	234.04
MDL Number	MFCD00052688
SMILES	C1=CC(=CC=C1NN)I
Synonym	4-iodophenyl hydrazine,1-4-iodophenyl hydrazine,4-iodo-phenyl-hydrazine,4-iodo phenyl hydrazine,p-iodophenyl-hydrazine,4-iodophenyl diazane,pubchem15797,acmc-1brf1,1-hydrazino-4-iodobenzene,4-iodophenylhydrazine
IUPAC Name	(4-iodophenyl)hydrazine
InChI Key	IQMLCMKMSBMMGR-UHFFFAOYSA-N
Molecular Formula	C₆H₇IN₂

3,890

2-(Morpholinosulfonyl)benzylamine hydrochloride, 97%, Thermo Scientific™

CAS: 918812-18-7 Molecular Formula: C11H17ClN2O3S Molecular Weight (g/mol): 292.778 MDL Number: MFCD09284586 InChI Key: RMMDNVBLYNZQFP-UHFFFAOYSA-N Synonym: 2-morpholinosulfonyl benzylamine hydrochloride,1-2-morpholin-4-ylsulfonyl phenyl methanamine hydrochloride,2-morpholine-4-sulfonyl phenyl methanamine hydrochloride,1-2-morpholine-4-sulfonyl phenyl methanamine hydrochloride,2-morpholinosulfonyl phenyl methanamine hydrochloride,2-morpholinosulfonyl phenyl methanamine hydrochloride salt,1-2-morpholine-4-sulfonyl phenyl methanamine-hydrogen chloride 1/1 PubChem CID: 16320333 IUPAC Name: (2-morpholin-4-ylsulfonylphenyl)methanamine;hydrochloride SMILES: C1COCCN1S(=O)(=O)C2=CC=CC=C2CN.Cl

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Specifications

PubChem CID	16320333
CAS	918812-18-7
Molecular Weight (g/mol)	292.778
MDL Number	MFCD09284586
SMILES	C1COCCN1S(=O)(=O)C2=CC=CC=C2CN.Cl
Synonym	2-morpholinosulfonyl benzylamine hydrochloride,1-2-morpholin-4-ylsulfonyl phenyl methanamine hydrochloride,2-morpholine-4-sulfonyl phenyl methanamine hydrochloride,1-2-morpholine-4-sulfonyl phenyl methanamine hydrochloride,2-morpholinosulfonyl phenyl methanamine hydrochloride,2-morpholinosulfonyl phenyl methanamine hydrochloride salt,1-2-morpholine-4-sulfonyl phenyl methanamine-hydrogen chloride 1/1
IUPAC Name	(2-morpholin-4-ylsulfonylphenyl)methanamine;hydrochloride
InChI Key	RMMDNVBLYNZQFP-UHFFFAOYSA-N
Molecular Formula	C11H17ClN2O3S

3,891

1-(4-Bromophenyl)-3,5-dimethyl-1H-pyrazole, 97%, Thermo Scientific™

CAS: 62546-27-4 Molecular Formula: C11H11BrN2 Molecular Weight (g/mol): 251.127 MDL Number: MFCD09817558 InChI Key: ATCMNDCOEJOOSF-UHFFFAOYSA-N Synonym: 1-4-bromophenyl-3,5-dimethyl-1h-pyrazole,1-4-bromophenyl-3,5-dimethylpyrazole,1h-pyrazole, 1-4-bromophenyl-3,5-dimethyl,acmc-209n4v PubChem CID: 24229761 IUPAC Name: 1-(4-bromophenyl)-3,5-dimethylpyrazole SMILES: CC1=CC(=NN1C2=CC=C(C=C2)Br)C

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Specifications

PubChem CID	24229761
CAS	62546-27-4
Molecular Weight (g/mol)	251.127
MDL Number	MFCD09817558
SMILES	CC1=CC(=NN1C2=CC=C(C=C2)Br)C
Synonym	1-4-bromophenyl-3,5-dimethyl-1h-pyrazole,1-4-bromophenyl-3,5-dimethylpyrazole,1h-pyrazole, 1-4-bromophenyl-3,5-dimethyl,acmc-209n4v
IUPAC Name	1-(4-bromophenyl)-3,5-dimethylpyrazole
InChI Key	ATCMNDCOEJOOSF-UHFFFAOYSA-N
Molecular Formula	C11H11BrN2

3,892

2-[2-(Dimethylamino)ethoxy]benzylamine, 90%, Thermo Scientific™

CAS: 91215-97-3 Molecular Formula: C11H18N2O Molecular Weight (g/mol): 194.28 MDL Number: MFCD08690290 InChI Key: NOZRJUDRDVKQDW-UHFFFAOYSA-N Synonym: 2-2-dimethylamino ethoxy benzylamine,2-2-dimethylamino ethoxy phenyl methanamine,2-2-aminomethyl phenoxy-n,n-dimethylethanamine,2-2-aminomethyl phenoxy-n,n-dimethyl-ethanamine,2-2-dimethylamino ethoxy benzenemethanamine,2-2-aminomethyl phenoxy ethyl dimethylamine,n,n-dimethyl-2-2-aminomethyl phenoxy ethylamine,n-2-2-aminomethyl phenoxy ethyl-n,n-dimethylamine PubChem CID: 235943 IUPAC Name: 2-[2-(aminomethyl)phenoxy]-N,N-dimethylethanamine SMILES: CN(C)CCOC1=CC=CC=C1CN

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Specifications

PubChem CID	235943
CAS	91215-97-3
Molecular Weight (g/mol)	194.28
MDL Number	MFCD08690290
SMILES	CN(C)CCOC1=CC=CC=C1CN
Synonym	2-2-dimethylamino ethoxy benzylamine,2-2-dimethylamino ethoxy phenyl methanamine,2-2-aminomethyl phenoxy-n,n-dimethylethanamine,2-2-aminomethyl phenoxy-n,n-dimethyl-ethanamine,2-2-dimethylamino ethoxy benzenemethanamine,2-2-aminomethyl phenoxy ethyl dimethylamine,n,n-dimethyl-2-2-aminomethyl phenoxy ethylamine,n-2-2-aminomethyl phenoxy ethyl-n,n-dimethylamine
IUPAC Name	2-[2-(aminomethyl)phenoxy]-N,N-dimethylethanamine
InChI Key	NOZRJUDRDVKQDW-UHFFFAOYSA-N
Molecular Formula	C11H18N2O

3,893

2-[3-(Dimethylamino)propoxy]-N-methylbenzylamine, ≥97%, Thermo Scientific™

CAS: 910037-06-8 Molecular Formula: C13H22N2O Molecular Weight (g/mol): 222.332 MDL Number: MFCD09064998 InChI Key: PSLNWMDOKBMVNV-UHFFFAOYSA-N Synonym: 2-3-dimethylamino propoxy-n-methylbenzylamine,dimethyl 3-2-methylamino methyl phenoxy propyl amine,2-3-dimethylamino propoxy phenyl methyl methyl amine,n,n-dimethyl-3-2-methylamino methyl phenoxy propan-1-amine,benzenemethanamine,2-3-dimethylamino propoxy-n-methyl PubChem CID: 24229613 IUPAC Name: N,N-dimethyl-3-[2-(methylaminomethyl)phenoxy]propan-1-amine SMILES: CNCC1=CC=CC=C1OCCCN(C)C

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Specifications

PubChem CID	24229613
CAS	910037-06-8
Molecular Weight (g/mol)	222.332
MDL Number	MFCD09064998
SMILES	CNCC1=CC=CC=C1OCCCN(C)C
Synonym	2-3-dimethylamino propoxy-n-methylbenzylamine,dimethyl 3-2-methylamino methyl phenoxy propyl amine,2-3-dimethylamino propoxy phenyl methyl methyl amine,n,n-dimethyl-3-2-methylamino methyl phenoxy propan-1-amine,benzenemethanamine,2-3-dimethylamino propoxy-n-methyl
IUPAC Name	N,N-dimethyl-3-[2-(methylaminomethyl)phenoxy]propan-1-amine
InChI Key	PSLNWMDOKBMVNV-UHFFFAOYSA-N
Molecular Formula	C13H22N2O

3,894

3-[3-(Dimethylamino)propoxy]-N-methylbenzylamine, 97%, Thermo Scientific™

CAS: 910037-03-5 Molecular Formula: C13H22N2O Molecular Weight (g/mol): 222.33 MDL Number: MFCD09064992 InChI Key: ODWHICGCLWFLBT-UHFFFAOYSA-N Synonym: 3-3-dimethylamino propoxy-n-methylbenzylamine,dimethyl 3-3-methylamino methyl phenoxy propyl amine,3-3-dimethylamino propoxy phenyl methyl methyl amine,n,n-dimethyl-3-3-methylamino methyl phenoxy propan-1-amine,benzenemethanamine, 3-3-dimethylamino propoxy-n-methyl,benzenemethanamine,3-3-dimethylamino propoxy-n-methyl PubChem CID: 24229606 IUPAC Name: N,N-dimethyl-3-[3-(methylaminomethyl)phenoxy]propan-1-amine SMILES: CNCC1=CC(OCCCN(C)C)=CC=C1

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Specifications

PubChem CID	24229606
CAS	910037-03-5
Molecular Weight (g/mol)	222.33
MDL Number	MFCD09064992
SMILES	CNCC1=CC(OCCCN(C)C)=CC=C1
Synonym	3-3-dimethylamino propoxy-n-methylbenzylamine,dimethyl 3-3-methylamino methyl phenoxy propyl amine,3-3-dimethylamino propoxy phenyl methyl methyl amine,n,n-dimethyl-3-3-methylamino methyl phenoxy propan-1-amine,benzenemethanamine, 3-3-dimethylamino propoxy-n-methyl,benzenemethanamine,3-3-dimethylamino propoxy-n-methyl
IUPAC Name	N,N-dimethyl-3-[3-(methylaminomethyl)phenoxy]propan-1-amine
InChI Key	ODWHICGCLWFLBT-UHFFFAOYSA-N
Molecular Formula	C13H22N2O

3,895

o-Tolidine dihydrochloride, 97%

CAS: 612-82-8 Molecular Formula: C14H18Cl2N2 Molecular Weight (g/mol): 285.212 MDL Number: MFCD00012960 InChI Key: LUKPNZHXJRJBAN-UHFFFAOYSA-N Synonym: 3,3'-dimethylbenzidine dihydrochloride,o-tolidine dihydrochloride,3,3'-dimethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-5msk350kd8,dsstox_cid_511,dsstox_rid_75633,dsstox_gsid_20511,tolidine dihydrochloride,1,1'-biphenyl-4,4'-diamine, 3,3'-dimethyl-, dihydrochloride,3,3'-dimethylbenzidine.2hcl PubChem CID: 108938 IUPAC Name: 4-(4-amino-3-methylphenyl)-2-methylaniline;dihydrochloride SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N.Cl.Cl

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Specifications

PubChem CID	108938
CAS	612-82-8
Molecular Weight (g/mol)	285.212
MDL Number	MFCD00012960
SMILES	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N.Cl.Cl
Synonym	3,3'-dimethylbenzidine dihydrochloride,o-tolidine dihydrochloride,3,3'-dimethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-5msk350kd8,dsstox_cid_511,dsstox_rid_75633,dsstox_gsid_20511,tolidine dihydrochloride,1,1'-biphenyl-4,4'-diamine, 3,3'-dimethyl-, dihydrochloride,3,3'-dimethylbenzidine.2hcl
IUPAC Name	4-(4-amino-3-methylphenyl)-2-methylaniline;dihydrochloride
InChI Key	LUKPNZHXJRJBAN-UHFFFAOYSA-N
Molecular Formula	C14H18Cl2N2

3,896

3-Methylsulphonylbenzoic acid, 95%, Thermo Scientific™

CAS: 5345-27-7 Molecular Formula: C₈H₈O₄S Molecular Weight (g/mol): 200.22 MDL Number: MFCD00216488 InChI Key: KUTBMATZUQWFSR-UHFFFAOYSA-N Synonym: 3-methylsulfonyl benzoic acid,3-methylsulphonyl benzoic acid,3-methylsulphonylbenzoic acid,3-methanesulfonylbenzoic acid,3-methanesulfonyl-benzoic acid,benzoic acid, 3-methylsulfonyl,3-mesylbenzoic acid,pubchem10870,acmc-1auq1 PubChem CID: 220380 IUPAC Name: 3-methylsulfonylbenzoic acid SMILES: CS(=O)(=O)C1=CC=CC(=C1)C(=O)O

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Specifications

PubChem CID	220380
CAS	5345-27-7
Molecular Weight (g/mol)	200.22
MDL Number	MFCD00216488
SMILES	CS(=O)(=O)C1=CC=CC(=C1)C(=O)O
Synonym	3-methylsulfonyl benzoic acid,3-methylsulphonyl benzoic acid,3-methylsulphonylbenzoic acid,3-methanesulfonylbenzoic acid,3-methanesulfonyl-benzoic acid,benzoic acid, 3-methylsulfonyl,3-mesylbenzoic acid,pubchem10870,acmc-1auq1
IUPAC Name	3-methylsulfonylbenzoic acid
InChI Key	KUTBMATZUQWFSR-UHFFFAOYSA-N
Molecular Formula	C₈H₈O₄S

3,897

Methyl 2-aminopyridine-4-carboxylate, 98%

CAS: 6937-03-7 Molecular Formula: C₇H₈N₂O₂ Molecular Weight (g/mol): 152.15 MDL Number: MFCD04039316 InChI Key: SVWWNEYBEFASMP-UHFFFAOYSA-N IUPAC Name: methyl 2-aminopyridine-4-carboxylate

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Specifications

CAS	6937-03-7
Molecular Weight (g/mol)	152.15
MDL Number	MFCD04039316
IUPAC Name	methyl 2-aminopyridine-4-carboxylate
InChI Key	SVWWNEYBEFASMP-UHFFFAOYSA-N
Molecular Formula	C₇H₈N₂O₂

3,898

2-Methoxyphenylboronic acid, 97%

CAS: 5720-06-9 Molecular Formula: C7H9BO3 Molecular Weight (g/mol): 151.96 MDL Number: MFCD00236047 InChI Key: ROEQGIFOWRQYHD-UHFFFAOYSA-N SMILES: COC1=CC=CC=C1B(O)O

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Specifications

CAS	5720-06-9
Molecular Weight (g/mol)	151.96
MDL Number	MFCD00236047
SMILES	COC1=CC=CC=C1B(O)O
InChI Key	ROEQGIFOWRQYHD-UHFFFAOYSA-N
Molecular Formula	C7H9BO3

3,899

2-Bromo-5-nitrobenzoic acid, Thermo Scientific™

CAS: 943-14-6 Molecular Formula: C₇H₄BrNO₄ Molecular Weight (g/mol): 246.02 MDL Number: MFCD00134558 InChI Key: UVFWYVCDRKRAJH-UHFFFAOYSA-N Synonym: 2-bromo-5-nitrobenzoic acid,2-bromo-5-nitrobenzic acid,benzoic acid, 2-bromo-5-nitro,2-bromo-5-nitrobenzoicacid,2-bromo-5-nitro benzoic acid,pubchem3821,acmc-209rrc,ksc494m1r,paragos 440009,timtec-bb sbb003179 PubChem CID: 243025 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Br

Pricing & Availability
Specifications

PubChem CID	243025
CAS	943-14-6
Molecular Weight (g/mol)	246.02
MDL Number	MFCD00134558
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Br
Synonym	2-bromo-5-nitrobenzoic acid,2-bromo-5-nitrobenzic acid,benzoic acid, 2-bromo-5-nitro,2-bromo-5-nitrobenzoicacid,2-bromo-5-nitro benzoic acid,pubchem3821,acmc-209rrc,ksc494m1r,paragos 440009,timtec-bb sbb003179
InChI Key	UVFWYVCDRKRAJH-UHFFFAOYSA-N
Molecular Formula	C₇H₄BrNO₄

3,900

2-(2-Bromophenyl)-1,3-dioxolane, 98%

CAS: 34824-58-3 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00155124 InChI Key: IWSGKSUCFVOWQU-UHFFFAOYSA-N Synonym: 2-2-bromophenyl-1,3-dioxolane,2-bromobenzaldehyde ethylene acetal,1,3-dioxolane, 2-2-bromophenyl,1-bromo-2-1,3-dioxolan-2-yl benzene,2-bromophenyldioxolane,2-bromo benzaldehyde ethylene glycol acetal,2-2-bromo-phenyl-1,3 dioxolane,pubchem3729,acmc-1csyy,bromobenzaldehyde ethylene acetal PubChem CID: 553534 IUPAC Name: 2-(2-bromophenyl)-1,3-dioxolane SMILES: BrC1=CC=CC=C1C1OCCO1

Pricing & Availability
Specifications

PubChem CID	553534
CAS	34824-58-3
Molecular Weight (g/mol)	229.07
MDL Number	MFCD00155124
SMILES	BrC1=CC=CC=C1C1OCCO1
Synonym	2-2-bromophenyl-1,3-dioxolane,2-bromobenzaldehyde ethylene acetal,1,3-dioxolane, 2-2-bromophenyl,1-bromo-2-1,3-dioxolan-2-yl benzene,2-bromophenyldioxolane,2-bromo benzaldehyde ethylene glycol acetal,2-2-bromo-phenyl-1,3 dioxolane,pubchem3729,acmc-1csyy,bromobenzaldehyde ethylene acetal
IUPAC Name	2-(2-bromophenyl)-1,3-dioxolane
InChI Key	IWSGKSUCFVOWQU-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

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