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Home > Pyridines > 911832-39-8
911832-39-8 | 2-[(pyridin-4-yl)methoxy]benzonitrile
CAS No: 911832-39-8 Catalog No: AG01BXKE MDL No:MFCD09945312
Product Description
Catalog Number:
AG01BXKE
Chemical Name:
2-[(pyridin-4-yl)methoxy]benzonitrile
CAS Number:
911832-39-8
Molecular Formula:
C13H10N2O
Molecular Weight:
210.2313
MDL Number:
MFCD09945312
IUPAC Name:
2-(pyridin-4-ylmethoxy)benzonitrile
InChI:
InChI=1S/C13H10N2O/c14-9-12-3-1-2-4-13(12)16-10-11-5-7-15-8-6-11/h1-8H,10H2
InChI Key:
AYLLRHVCUUUHSF-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1OCc1ccncc1
Properties
Complexity:
252
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:
0
Isotope Atom Count:
0
Molecular Weight:
210.236g/mol
Monoisotopic Mass:
210.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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