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1985-81-5 | 1,4,7-Heptanetriamine
CAS No: 1985-81-5 Catalog No: AG002BKO MDL No:
Product Description
Catalog Number:
AG002BKO
Chemical Name:
1,4,7-Heptanetriamine
CAS Number:
1985-81-5
Molecular Formula:
C7H19N3
Molecular Weight:
145.2459
IUPAC Name:
heptane-1,4,7-triamine
InChI:
InChI=1S/C7H19N3/c8-5-1-3-7(10)4-2-6-9/h7H,1-6,8-10H2
InChI Key:
GDRJDUSGGPSMEI-UHFFFAOYSA-N
SMILES:
NCCCC(CCCN)N
Properties
Complexity:
57.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.158g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
145.25g/mol
Monoisotopic Mass:
145.158g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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