2-Bromo-2-cyclohexen-1-ol

CAT: 0127-OR1049873-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1049873-01Size:100 mg

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

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CAS Number

61426-49-1

MDL Number

MFCD11054952

Purity

95%

Smiles

OC1C(Br)=CCCC1

Chemical Information

2-Bromocyclohex-2-en-1-ol

CAS Number	61426-49-1
PubChem CID	11805276
IUPAC Name	2-bromocyclohex-2-en-1-ol
Molecular Formula	C6H9BrO
Molecular Weight	177.04
XLogP	1.4
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	109

SMILES

C1CC=C(C(C1)O)Br

InChI

InChI=1S/C6H9BrO/c7-5-3-1-2-4-6(5)8/h3,6,8H,1-2,4H2

InChIKey

SVDKKDWANPIULS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 61426-49-1

CID: 11805276

Formula: C6H9BrO

MW: 177.04

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	177.04
XLogP3	1.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	175.98368
Monoisotopic Mass	175.98368
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	109
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC1012231-01	1- (5-Bromo-2-fluorophenyl) -2-cyclohexen-1-ol
OR1083716-01	4-Bromo-3-cyclohexen-1-ol
OR1085442-01	1- (2-Phenylethynyl) -2-cyclohexen-1-ol
OR1084902-01	1- (2-Methoxyphenyl) -2-cyclohexen-1-ol
OR1096943	3-Cyclohexen-1-ol, 4-bromo-, 1-benzoate
PC1012288-01	1- (2,3-Difluorophenyl) -2-cyclohexen-1-ol
PC1012208-01	1- (2,5-Difluorophenyl) -2-cyclohexen-1-ol
OR1084777-01	1- (4-Ethylphenyl) -2-cyclohexen-1-ol
PC1012245-01	1- (3-Fluorophenyl) -2-cyclohexen-1-ol
OR1084760-01	1- (3-Chlorophenyl) -2-cyclohexen-1-ol

Catalog	Name
LCA42649-01	2-Bromo-2-cyclohexen-1-ol
HY-W010617-01	2-Cyclohexen-1-ol
JH220230	Methyl-2-cyclohexen-1-ol
sc-238589	3-Methyl-2-cyclohexen-1-ol
sc-483330	1-Methyl-4- (1-methylethenyl) -2-cyclohexen-1-ol
AR-C08626-01	4-Methyl-1- (1-methylethenyl) -2-Cyclohexen-1-ol
TN9202-01	3,5,5-Trimethyl-2-cyclohexen-1-ol
TRC-B813965-1G	2-Bromo-2-methylpropan-1-ol
RG-P022648-01	1-Bromo-2-Methylpropan-2-Ol
PDK0407	2-Cyclohexen-1-one