4-Bromocyclopent-1-ene

CAT: 0926-BAA78166-01Size: 500 gDry Ice: NoHazardous: No

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CAT#:0926-BAA78166-01Size:500 g

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CAS Number

1781-66-4

MDL Number

MFCD20621318

Smiles

C1C=CCC1Br

Molecular Formula

C5H7Br

Molecular Weight

147.01 g/mol

Controlled

Chemical Information

Cyclopentene, 4-bromo-

CAS Number	1781-66-4
PubChem CID	312699
IUPAC Name	4-bromocyclopentene
Molecular Formula	C5H7Br
Molecular Weight	147.01
XLogP	2.2
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	6
Formal Charge	0
Complexity	58

SMILES

C1C=CCC1Br

InChI

InChI=1S/C5H7Br/c6-5-3-1-2-4-5/h1-2,5H,3-4H2

InChIKey

GGKPXSIBMKNXJA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1781-66-4

CID: 312699

Formula: C5H7Br

MW: 147.01

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	147.01
XLogP3	2.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	145.97311
Monoisotopic Mass	145.97311
Topological Polar Surface Area	0 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	58.3
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
TAA31764	1-Bromocyclohept-1-ene
LBA29149-01	3-Bromocyclohept-1-ene
LDA48828-01	2-Bromocyclopent-2-en-1-ol
KAA48134-01	2-Bromocyclopent-2-en-1-one
BCA86532-01	3-Bromocyclopent-2-en-1-one
EAA10388-01	4-Isocyanatocyclohex-1-ene
GAD33254-01	1-Bromo-4,4-difluorocyclohex-1-ene
ZCA57248-01	4- (Isocyanatomethyl) cyclohex-1-ene
FCA03057-01	2,4-Dibromobut-1-ene
BAC92382-01	4-Ethylcyclohex-1-ene-1-carbonitrile