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72235-44-0 | 1,8-Naphthyridine-3,4-diamine
CAS No: 72235-44-0 Catalog No: AG005J5E MDL No:
Product Description
Catalog Number:
AG005J5E
Chemical Name:
1,8-Naphthyridine-3,4-diamine
CAS Number:
72235-44-0
Molecular Formula:
C8H8N4
Molecular Weight:
160.1759
IUPAC Name:
1,8-naphthyridine-3,4-diamine
InChI:
InChI=1S/C8H8N4/c9-6-4-12-8-5(7(6)10)2-1-3-11-8/h1-4H,9H2,(H2,10,11,12)
InChI Key:
MSLIZVBCUVDYDJ-UHFFFAOYSA-N
SMILES:
Nc1cnc2c(c1N)cccn2
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
160.18g/mol
Monoisotopic Mass:
160.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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