Home Nitriles [1-(Bromomethyl)cyclopropyl]acetonitrile

[1-(Bromomethyl)cyclopropyl]acetonitrile

CAS No.:
338392-48-6
Catalog Number:
AG00IKWL
Molecular Formula:
C6H8BrN
Molecular Weight:
174.0384
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Product Description
Catalog Number:
AG00IKWL
Chemical Name:
[1-(Bromomethyl)cyclopropyl]acetonitrile
CAS Number:
338392-48-6
Molecular Formula:
C6H8BrN
Molecular Weight:
174.0384
MDL Number:
MFCD11977652
IUPAC Name:
2-[1-(bromomethyl)cyclopropyl]acetonitrile
InChI:
InChI=1S/C6H8BrN/c7-5-6(1-2-6)3-4-8/h1-3,5H2
InChI Key:
UBRCXYVILSTTRU-UHFFFAOYSA-N
SMILES:
BrCC1(CC1)CC#N
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.984g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.041g/mol
Monoisotopic Mass:
172.984g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties