1-Bromo-1-chloroethane

CAT: 0127-OR1101361Size: 1 EachDry Ice: NoHazardous: No

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CAS Number

593-96-4

MDL Number

MFCD00018842

Smiles

CC (Cl) Br

Chemical Information

1-Bromo-1-chloroethane

CAS Number	593-96-4
PubChem CID	11654
IUPAC Name	1-bromo-1-chloroethane
Molecular Formula	C2H4BrCl
Molecular Weight	143.41
XLogP	2.1
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	4
Formal Charge	0
Complexity	15

SMILES

CC(Cl)Br

InChI

InChI=1S/C2H4BrCl/c1-2(3)4/h2H,1H3

InChIKey

QMSVNDSDEZTYAS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 593-96-4

CID: 11654

Formula: C2H4BrCl

MW: 143.41

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	143.41
XLogP3	2.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	141.91849
Monoisotopic Mass	141.91849
Topological Polar Surface Area	0 Å²
Heavy Atom Count	4
Formal Charge	0
Complexity	15.5
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

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