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Home > Pyridines > 174406-31-6
174406-31-6 | 2-[(pyridin-4-yl)methyl]phenol
CAS No: 174406-31-6 Catalog No: AG01C3R7 MDL No:MFCD25994232
Product Description
Catalog Number:
AG01C3R7
Chemical Name:
2-[(pyridin-4-yl)methyl]phenol
CAS Number:
174406-31-6
Molecular Formula:
C12H11NO
Molecular Weight:
185.2218
MDL Number:
MFCD25994232
IUPAC Name:
2-(pyridin-4-ylmethyl)phenol
InChI:
InChI=1S/C12H11NO/c14-12-4-2-1-3-11(12)9-10-5-7-13-8-6-10/h1-8,14H,9H2
InChI Key:
SHBJTFKANZPDON-UHFFFAOYSA-N
SMILES:
Oc1ccccc1Cc1ccncc1
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.226g/mol
Monoisotopic Mass:
185.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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