Home Nitriles 3-(3-methoxyphenoxy)propanenitrile

3-(3-methoxyphenoxy)propanenitrile

CAS No.:
6279-84-1
Catalog Number:
AG00F3DQ
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
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Product Description
Catalog Number:
AG00F3DQ
Chemical Name:
3-(3-methoxyphenoxy)propanenitrile
CAS Number:
6279-84-1
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD00598421
IUPAC Name:
3-(3-methoxyphenoxy)propanenitrile
InChI:
InChI=1S/C10H11NO2/c1-12-9-4-2-5-10(8-9)13-7-3-6-11/h2,4-5,8H,3,7H2,1H3
InChI Key:
FUGAVKXXJLPDPT-UHFFFAOYSA-N
SMILES:
N#CCCOc1cccc(c1)OC
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties