Home Nitriles 4-[Hydroxy(2-methylphenyl)methyl]benzonitrile

4-[Hydroxy(2-methylphenyl)methyl]benzonitrile

CAS No.:
944517-45-7
Catalog Number:
AG00H7IG
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00H7IG
Chemical Name:
4-[Hydroxy(2-methylphenyl)methyl]benzonitrile
CAS Number:
944517-45-7
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
MDL Number:
MFCD11096854
IUPAC Name:
4-[hydroxy-(2-methylphenyl)methyl]benzonitrile
InChI:
InChI=1S/C15H13NO/c1-11-4-2-3-5-14(11)15(17)13-8-6-12(10-16)7-9-13/h2-9,15,17H,1H3
InChI Key:
JIGFPFBDFWBPAN-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)C(c1ccccc1C)O
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties