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89151-17-7 | 1,3-Propanediamine, N-[1-(4-pyridinyl)propyl]-
CAS No: 89151-17-7 Catalog No: AG003XAI MDL No:
Product Description
Catalog Number:
AG003XAI
Chemical Name:
1,3-Propanediamine, N-[1-(4-pyridinyl)propyl]-
CAS Number:
89151-17-7
Molecular Formula:
C11H19N3
Molecular Weight:
193.2887
IUPAC Name:
N'-(1-pyridin-4-ylpropyl)propane-1,3-diamine
InChI:
InChI=1S/C11H19N3/c1-2-11(14-7-3-6-12)10-4-8-13-9-5-10/h4-5,8-9,11,14H,2-3,6-7,12H2,1H3
InChI Key:
BFQYTKDJEOAHON-UHFFFAOYSA-N
SMILES:
NCCCNC(c1ccncc1)CC
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.158g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.294g/mol
Monoisotopic Mass:
193.158g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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