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39244-80-9 | 1-(Pyridin-3-ylmethyl)piperazine
CAS No: 39244-80-9 Catalog No: AG003CXT MDL No:MFCD01862552
Product Description
Catalog Number:
AG003CXT
Chemical Name:
1-(Pyridin-3-ylmethyl)piperazine
CAS Number:
39244-80-9
Molecular Formula:
C10H15N3
Molecular Weight:
177.2462
MDL Number:
MFCD01862552
IUPAC Name:
1-(pyridin-3-ylmethyl)piperazine
InChI:
InChI=1S/C10H15N3/c1-2-10(8-12-3-1)9-13-6-4-11-5-7-13/h1-3,8,11H,4-7,9H2
InChI Key:
UNGUQQBXDOAOQO-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1cccnc1
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.127g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.251g/mol
Monoisotopic Mass:
177.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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