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1226016-52-9 | 3-Pyridineethanol, α-(aminomethyl)-
CAS No: 1226016-52-9 Catalog No: AG0017IM MDL No:
Product Description
Catalog Number:
AG0017IM
Chemical Name:
3-Pyridineethanol, α-(aminomethyl)-
CAS Number:
1226016-52-9
Molecular Formula:
C8H12N2O
Molecular Weight:
152.1937
IUPAC Name:
1-amino-3-pyridin-3-ylpropan-2-ol
InChI:
InChI=1S/C8H12N2O/c9-5-8(11)4-7-2-1-3-10-6-7/h1-3,6,8,11H,4-5,9H2
InChI Key:
QDQIFFYDUNWKKH-UHFFFAOYSA-N
SMILES:
NCC(Cc1cccnc1)O
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
152.197g/mol
Monoisotopic Mass:
152.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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