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2-​Bromo-​1-​chloropropane

CAT: 1596-AR-T06370-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-T06370-01Size:10 Units
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CAS Number
3017-95-6
Synonyms
2-bromo-1-chloropropane
Molecular Formula
C3H6BrCl
Molecular Weight
157.44
API Name
Trazodone

Chemical Information

2-Bromo-1-chloropropane

2-bromo-1-chloropropane is a colorless odorless liquid. Insoluble in water. Nonflammable.

CAS Number3017-95-6
PubChem CID18175
IUPAC Name2-bromo-1-chloropropane
Molecular FormulaC3H6BrCl
Molecular Weight157.44
XLogP2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count5
Formal Charge0
Complexity22
SMILES
CC(CCl)Br
InChI
InChI=1S/C3H6BrCl/c1-3(4)2-5/h3H,2H2,1H3
InChIKey
PUJJZGFFAQHYEX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Bromo-1-chloropropane
CAS: 3017-95-6
CID: 18175
Formula: C3H6BrCl
MW: 157.44
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight157.44
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass155.93414
Monoisotopic Mass155.93414
Topological Polar Surface Area0 Ų
Heavy Atom Count5
Formal Charge0
Complexity22.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes