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Details

Stereochemistry ACHIRAL
Molecular Formula C7H7Br
Molecular Weight 171.034
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of M-BROMOTOLUENE

SMILES

CC1=CC=CC(Br)=C1

InChI

InChIKey=WJIFKOVZNJTSGO-UHFFFAOYSA-N
InChI=1S/C7H7Br/c1-6-3-2-4-7(8)5-6/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C7H7Br
Molecular Weight 171.034
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Synthesis of conformationally constrained cyclic peptides using an intramolecular sonogashira coupling.
2005 Nov 11
3-(3-Bromo-benz-yl)isoquinolin-1(2H)-one.
2009 Dec 4
3-(3-Bromo-benz-yl)-1H-isochromen-1-one.
2009 Sep 26
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:32:18 GMT 2023
Edited
by admin
on Fri Dec 15 18:32:18 GMT 2023
Record UNII
9426O61G73
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
M-BROMOTOLUENE
Systematic Name English
3-TOLYL BROMIDE
Systematic Name English
3-METHYL-1-BROMOBENZENE
Systematic Name English
3-BROMOTOLUENE
HSDB  
Systematic Name English
3-BROMO-1-METHYLBENZENE
Systematic Name English
5-BROMOTOLUENE
Systematic Name English
M-BROMOMETHYLBENZENE
Systematic Name English
3-METHYLPHENYL BROMIDE
Systematic Name English
3-BROMOTOLUENE [HSDB]
Common Name English
BENZENE, 1-BROMO-3-METHYL-
Systematic Name English
M-METHYLPHENYL BROMIDE
Systematic Name English
Code System Code Type Description
CAS
591-17-3
Created by admin on Fri Dec 15 18:32:18 GMT 2023 , Edited by admin on Fri Dec 15 18:32:18 GMT 2023
PRIMARY
ECHA (EC/EINECS)
209-702-3
Created by admin on Fri Dec 15 18:32:18 GMT 2023 , Edited by admin on Fri Dec 15 18:32:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID3024659
Created by admin on Fri Dec 15 18:32:18 GMT 2023 , Edited by admin on Fri Dec 15 18:32:18 GMT 2023
PRIMARY
PUBCHEM
11560
Created by admin on Fri Dec 15 18:32:18 GMT 2023 , Edited by admin on Fri Dec 15 18:32:18 GMT 2023
PRIMARY
FDA UNII
9426O61G73
Created by admin on Fri Dec 15 18:32:18 GMT 2023 , Edited by admin on Fri Dec 15 18:32:18 GMT 2023
PRIMARY
HSDB
6014
Created by admin on Fri Dec 15 18:32:18 GMT 2023 , Edited by admin on Fri Dec 15 18:32:18 GMT 2023
PRIMARY