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21093-54-9 | 3-Pyridinemethanol, 2-(phenylamino)-
CAS No: 21093-54-9 Catalog No: AG002L34 MDL No:
Product Description
Catalog Number:
AG002L34
Chemical Name:
3-Pyridinemethanol, 2-(phenylamino)-
CAS Number:
21093-54-9
Molecular Formula:
C12H12N2O
Molecular Weight:
200.2365
IUPAC Name:
(2-anilinopyridin-3-yl)methanol
InChI:
InChI=1S/C12H12N2O/c15-9-10-5-4-8-13-12(10)14-11-6-2-1-3-7-11/h1-8,15H,9H2,(H,13,14)
InChI Key:
IQPOOTCWZFNUJR-UHFFFAOYSA-N
SMILES:
OCc1cccnc1Nc1ccccc1
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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