Home Nitriles 4-[Hydroxy(4-methoxyphenyl)methyl]benzonitrile

4-[Hydroxy(4-methoxyphenyl)methyl]benzonitrile

CAS No.:
174813-84-4
Catalog Number:
AG001ZYM
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$150
- +
5g
97%
In Stock USA
United States
$450
- +
10g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG001ZYM
Chemical Name:
4-[Hydroxy(4-methoxyphenyl)methyl]benzonitrile
CAS Number:
174813-84-4
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
MDL Number:
MFCD22192553
IUPAC Name:
4-[hydroxy-(4-methoxyphenyl)methyl]benzonitrile
InChI:
InChI=1S/C15H13NO2/c1-18-14-8-6-13(7-9-14)15(17)12-4-2-11(10-16)3-5-12/h2-9,15,17H,1H3
InChI Key:
QXJLWOYFDAVMLW-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(c1ccc(cc1)C#N)O
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties