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931751-65-4 | N-(3-Methoxypropyl)-3-nitropyridine-2-amine
CAS No: 931751-65-4 Catalog No: AG01FB4G MDL No:
Product Description
Catalog Number:
AG01FB4G
Chemical Name:
N-(3-Methoxypropyl)-3-nitropyridine-2-amine
CAS Number:
931751-65-4
Molecular Formula:
C9H13N3O3
Molecular Weight:
211.2178
IUPAC Name:
N-(3-methoxypropyl)-3-nitropyridin-2-amine
InChI:
InChI=1S/C9H13N3O3/c1-15-7-3-6-11-9-8(12(13)14)4-2-5-10-9/h2,4-5H,3,6-7H2,1H3,(H,10,11)
InChI Key:
IEULFROBCQXLEN-UHFFFAOYSA-N
SMILES:
COCCCNc1ncccc1[N+](=O)[O-]
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.096g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.221g/mol
Monoisotopic Mass:
211.096g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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