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88010-00-8 | 1,3,5-Benzenetriamine, hydrochloride
CAS No: 88010-00-8 Catalog No: AG004NXP MDL No:
Product Description
Catalog Number:
AG004NXP
Chemical Name:
1,3,5-Benzenetriamine, hydrochloride
CAS Number:
88010-00-8
Molecular Formula:
C6H10ClN3
Molecular Weight:
159.6167
IUPAC Name:
benzene-1,3,5-triamine;hydrochloride
InChI:
InChI=1S/C6H9N3.ClH/c7-4-1-5(8)3-6(9)2-4;/h1-3H,7-9H2;1H
InChI Key:
AJHDRXSTMDYFOL-UHFFFAOYSA-N
SMILES:
Nc1cc(N)cc(c1)N.Cl
Properties
Complexity:
63.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.056g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
159.617g/mol
Monoisotopic Mass:
159.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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