2-Bromobutene

CAT: 0127-OR1076687-02Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1076687-02Size:25 g

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

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CAS Number

23074-36-4

MDL Number

MFCD00039178

Purity

97%

Smiles

CCC(Br)=C

Chemical Information

1-Butene, 2-bromo-

CAS Number	23074-36-4
PubChem CID	89990
IUPAC Name	2-bromobut-1-ene
Molecular Formula	C4H7Br
Molecular Weight	135.00
XLogP	2.4
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Heavy Atom Count	5
Formal Charge	0
Complexity	38

SMILES

CCC(=C)Br

InChI

InChI=1S/C4H7Br/c1-3-4(2)5/h2-3H2,1H3

InChIKey

HQMXRIGBXOFKIU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 23074-36-4

CID: 89990

Formula: C4H7Br

MW: 135.00

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	135.00
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	133.97311
Monoisotopic Mass	133.97311
Topological Polar Surface Area	0 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	38.9
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
OR4335-01	2-Bromobutane
OR46042-01	1-Bromobutane-2,3-dione
OR76627-01	4-Bromobutan-2-ol
OR85143-01	4-Bromobutan-2-one
OR1069337-01	(4-Bromobutan-2-yl) benzene
OR1040448-01	(R) -2-Bromobutane-1,4-diol
OR76657-01	Tert-Butyl (4-bromobutan-2-yl) carbamate
OR460056	1-Bromobutane
OR88099-01	1-Azido-4-bromobutane
OR1061839-01	3-Bromobutan-1-ol

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