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1243414-96-1 | 3-Pyridinol, 5-(aminomethyl)-
CAS No: 1243414-96-1 Catalog No: AG000LVK MDL No:MFCD16999626
Product Description
Catalog Number:
AG000LVK
Chemical Name:
3-Pyridinol, 5-(aminomethyl)-
CAS Number:
1243414-96-1
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
MDL Number:
MFCD16999626
IUPAC Name:
5-(aminomethyl)pyridin-3-ol
InChI:
InChI=1S/C6H8N2O/c7-2-5-1-6(9)4-8-3-5/h1,3-4,9H,2,7H2
InChI Key:
LXMHSJKKDQCDKN-UHFFFAOYSA-N
SMILES:
NCc1cc(O)cnc1
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.064g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
124.143g/mol
Monoisotopic Mass:
124.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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