5-Bromohex-1-ene

CAT: 0127-OR55112Size: 1 EachDry Ice: NoHazardous: No

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CAT#:0127-OR55112Size:1 Each

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CAS Number

4558-27-4

Synonyms

5-Bromo-1-hexene

MDL Number

MFCD00049141

Purity

96%

Smiles

CC(Br)CCC=C

Storage Conditions

Store at 2-8°C

Chemical Information

5-Bromohex-1-ene

CAS Number	4558-27-4
PubChem CID	138294
IUPAC Name	5-bromohex-1-ene
Molecular Formula	C6H11Br
Molecular Weight	163.06
XLogP	2.9
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	3
Heavy Atom Count	7
Formal Charge	0
Complexity	50

SMILES

CC(CCC=C)Br

InChI

InChI=1S/C6H11Br/c1-3-4-5-6(2)7/h3,6H,1,4-5H2,2H3

InChIKey

AIAXFFLNNULCFG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4558-27-4

CID: 138294

Formula: C6H11Br

MW: 163.06

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	163.06
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	3
Exact Mass	162.00441
Monoisotopic Mass	162.00441
Topological Polar Surface Area	0 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	50.1
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
VFA96722-01	1-Bromohex-5-en-2-one
HY-W186967-01	6-Bromohex-1-yne
AAA92850	5-Chloropent-1-ene
REA91184-01	5-Chloro-5-methylhex-1-ene
FCA40212-01	6-Bromohex-2-yne
JH469608	Methyl 6-bromohex-2-enoate
RG-A261139-01	3,5-Dimethylhex-1-Ene
NEA35831-01	5- (Bromomethyl) cyclohept-1-ene
GTR19223615-01	Dec-5-ene
EGA22275-01	5,5-Dimethylcyclopent-1-ene-1-carboxylic acid