Home Nitriles Benzonitrile, 4-(methoxymethyl)-

Benzonitrile, 4-(methoxymethyl)-

CAS No.:
1515-85-1
Catalog Number:
AG001NDJ
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001NDJ
Chemical Name:
Benzonitrile, 4-(methoxymethyl)-
CAS Number:
1515-85-1
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD09937189
IUPAC Name:
4-(methoxymethyl)benzonitrile
InChI:
InChI=1S/C9H9NO/c1-11-7-9-4-2-8(6-10)3-5-9/h2-5H,7H2,1H3
InChI Key:
RUWUCOYLNIGKRD-UHFFFAOYSA-N
SMILES:
COCc1ccc(cc1)C#N
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties