Home Nitriles 4-[(4-methoxyphenyl)methoxy]butanenitrile

4-[(4-methoxyphenyl)methoxy]butanenitrile

CAS No.:
1021042-96-5
Catalog Number:
AG01A2YN
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
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Product Description
Catalog Number:
AG01A2YN
Chemical Name:
4-[(4-methoxyphenyl)methoxy]butanenitrile
CAS Number:
1021042-96-5
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD11147567
IUPAC Name:
4-[(4-methoxyphenyl)methoxy]butanenitrile
InChI:
InChI=1S/C12H15NO2/c1-14-12-6-4-11(5-7-12)10-15-9-3-2-8-13/h4-7H,2-3,9-10H2,1H3
InChI Key:
WROFRRSYFNNNDX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)COCCCC#N
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties