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199666-36-9 | 1,3-Propanediamine, N1-(3-aminopropyl)-N1-(2-hydroxy-1-oxidodiazenyl)-
CAS No: 199666-36-9 Catalog No: AG002C9T MDL No:
Product Description
Catalog Number:
AG002C9T
Chemical Name:
1,3-Propanediamine, N1-(3-aminopropyl)-N1-(2-hydroxy-1-oxidodiazenyl)-
CAS Number:
199666-36-9
Molecular Formula:
C6H17N5O2
Molecular Weight:
191.2315
IUPAC Name:
[bis(3-aminopropyl)amino]-hydroxyimino-oxidoazanium
InChI:
InChI=1S/C6H17N5O2/c7-3-1-5-10(6-2-4-8)11(13)9-12/h12H,1-8H2
InChI Key:
DLNIKTWGBUNSSV-UHFFFAOYSA-N
SMILES:
NCCCN([N+](=NO)[O-])CCCN
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.138g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
191.235g/mol
Monoisotopic Mass:
191.138g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-0.7
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