1-Bromo-2-Methylbenzene

CAT: 1299-RG-P022514-01Size: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:1299-RG-P022514-01Size:10 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

95-46-5

Synonyms

1-bromo-2-methylbenzene

Molecular Formula

C7H7Br

Molecular Weight

171.04

Product Name Synonym

1-bromo-2-methylbenzene

Chemical Information

2-Bromotoluene

O-bromotoluene is a clear colorless to pale beige liquid. (NTP, 1992)

CAS Number	95-46-5
PubChem CID	7236
IUPAC Name	1-bromo-2-methylbenzene
Molecular Formula	C7H7Br
Molecular Weight	171.03
XLogP	3.5
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	70

SMILES

CC1=CC=CC=C1Br

InChI

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

InChIKey

QSSXJPIWXQTSIX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 95-46-5

CID: 7236

Formula: C7H7Br

MW: 171.03

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	171.03
XLogP3	3.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	169.97311
Monoisotopic Mass	169.97311
Topological Polar Surface Area	0 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	70.8
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RG-C081267-01	1-Chloro-2-Methylbenzene
RG-A260425-01	1-Ethyl-2-Methylbenzene
RG-M200813-01	2-Methylbenzene-1,3-Diamine
RG-M200806-01	2-Methylbenzene-1,4-Diamine
RG-A260178-01	1,2-Dichloro-3-Methylbenzene
RG-M200814-01	1,3-Difluoro-2-Methylbenzene
RG-E140606-01	1,3-dichloro-2-methylbenzene
RG-A262618-01	4-Methylbenzene-1,2,3-Triol
RG-M200802-01	N1-Methylbenzene-1,2-Diamine Dihydrochloride
RG-A263532-01	1- (Chloro (Phenyl) Methyl) -2-Methylbenzene

Catalog	Name
1021730 25	2-Bromo Toluene for Synthesis (1-Bromo-2-Methylbenzene)
ZCA73834-01	4-Bromo-2-isocyanato-1-methylbenzene
PAA39551-01	4-Bromo-2-methylbenzene-1-thiol
NKB21421	2-bromo-1-iodo-3-methylbenzene
MEA29962	1-Bromo-3- (bromomethyl) -2-methylbenzene
TRC-B696545-500MG	4-Bromo-1-methanesulfonyl-2-methylbenzene
430814-01	4-Bromo-2-methoxy-1-methylbenzene
429349-01	4- (Benzyloxy) -1-bromo-2-methylbenzene
409193-01	1-Bromo-3- (2-methoxyethoxy) methylbenzene
408325-01	1- (Benzyloxy) -4-bromo-2-methylbenzene