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Home > Nitro Compounds > 123792-68-7
123792-68-7 | 1,6-Naphthyridine, 5,6,7,8-tetrahydro-3-nitro-
CAS No: 123792-68-7 Catalog No: AG000L2V MDL No:MFCD07371644
Product Description
Catalog Number:
AG000L2V
Chemical Name:
1,6-Naphthyridine, 5,6,7,8-tetrahydro-3-nitro-
CAS Number:
123792-68-7
Molecular Formula:
C8H9N3O2
Molecular Weight:
179.1760
MDL Number:
MFCD07371644
IUPAC Name:
3-nitro-5,6,7,8-tetrahydro-1,6-naphthyridine
InChI:
InChI=1S/C8H9N3O2/c12-11(13)7-3-6-4-9-2-1-8(6)10-5-7/h3,5,9H,1-2,4H2
InChI Key:
JGYRPWPCCHANJO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc2c(c1)CNCC2
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.179g/mol
Monoisotopic Mass:
179.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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