Home Halogens 2-(2-bromoethoxy)propanenitrile

2-(2-bromoethoxy)propanenitrile

CAS No.:
854679-28-0
Catalog Number:
AG01B8TJ
Molecular Formula:
C5H8BrNO
Molecular Weight:
178.0271
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Product Description
Catalog Number:
AG01B8TJ
Chemical Name:
2-(2-bromoethoxy)propanenitrile
CAS Number:
854679-28-0
Molecular Formula:
C5H8BrNO
Molecular Weight:
178.0271
MDL Number:
MFCD20625063
IUPAC Name:
2-(2-bromoethoxy)propanenitrile
InChI:
InChI=1S/C5H8BrNO/c1-5(4-7)8-3-2-6/h5H,2-3H2,1H3
InChI Key:
QKPPRWKYEFVPGV-UHFFFAOYSA-N
SMILES:
CC(C#N)OCCBr
Properties
Complexity:
95.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.979g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.029g/mol
Monoisotopic Mass:
176.979g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties