Home Nitriles 3-(5-(Hydroxymethyl)pyridin-2-yl)benzonitrile

3-(5-(Hydroxymethyl)pyridin-2-yl)benzonitrile

CAS No.:
887974-34-7
Catalog Number:
AG004CTC
Molecular Formula:
C13H10N2O
Molecular Weight:
210.2313
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG004CTC
Chemical Name:
3-(5-(Hydroxymethyl)pyridin-2-yl)benzonitrile
CAS Number:
887974-34-7
Molecular Formula:
C13H10N2O
Molecular Weight:
210.2313
MDL Number:
MFCD06410453
IUPAC Name:
3-[5-(hydroxymethyl)pyridin-2-yl]benzonitrile
InChI:
InChI=1S/C13H10N2O/c14-7-10-2-1-3-12(6-10)13-5-4-11(9-16)8-15-13/h1-6,8,16H,9H2
InChI Key:
WWSMPTLEWQCUPC-UHFFFAOYSA-N
SMILES:
OCc1ccc(nc1)c1cccc(c1)C#N
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.079g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.236g/mol
Monoisotopic Mass:
210.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties