Home Nitriles 2-[(4-methoxyphenyl)methoxy]acetonitrile

2-[(4-methoxyphenyl)methoxy]acetonitrile

CAS No.:
1020944-81-3
Catalog Number:
AG01A821
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
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Product Description
Catalog Number:
AG01A821
Chemical Name:
2-[(4-methoxyphenyl)methoxy]acetonitrile
CAS Number:
1020944-81-3
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD11147566
IUPAC Name:
2-[(4-methoxyphenyl)methoxy]acetonitrile
InChI:
InChI=1S/C10H11NO2/c1-12-10-4-2-9(3-5-10)8-13-7-6-11/h2-5H,7-8H2,1H3
InChI Key:
OAWHYIVCYBJQAP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)COCC#N
Properties
Complexity:
177  
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:
1.3  
Properties