2-Bromophenol

CAT: 1299-RG-B181544-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-B181544-01Size:10 mg

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CAS Number

95-56-7

Synonyms

2-bromophenol

Molecular Formula

C6H5BrO

Molecular Weight

173.01

Product Name Synonym

2-bromophenol

Chemical Information

2-Bromophenol

2-bromophenol is a bromophenol. It has a role as a marine metabolite.

CAS Number	95-56-7
PubChem CID	7244
IUPAC Name	2-bromophenol
Molecular Formula	C6H5BrO
Molecular Weight	173.01
XLogP	2.4
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	74

SMILES

C1=CC=C(C(=C1)O)Br

InChI

InChI=1S/C6H5BrO/c7-5-3-1-2-4-6(5)8/h1-4,8H

InChIKey

VADKRMSMGWJZCF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 95-56-7

CID: 7244

Formula: C6H5BrO

MW: 173.01

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	173.01
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	171.95238
Monoisotopic Mass	171.95238
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	74.9
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-A130999-01	2-Amino-6-Bromophenol
RG-B181547-01	3-Bromophenol
RG-B181545-01	4-Bromophenol
RG-A261989-01	2-Bromophenyl Acetate
RG-B181572-01	1- (2-Bromophenyl) Piperazine
RG-A261192-01	N- (2-Bromophenyl) -3-Oxobutanamide
RG-A130904-01	(2-Amino-5-Bromophenyl) Methanol
RG-B181574-01	N- (2-Bromophenyl) Nitrous Amide
RG-B011500-01	(2-Amino-3-Bromophenyl) Methanol
RG-B181575-01	N- (2-Bromophenyl) -N-Methylnitrous Amide