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Home > Nitro Compounds > 30450-62-5
30450-62-5 | Quinoline, 1,2,3,4-tetrahydro-7-nitro-
CAS No: 30450-62-5 Catalog No: AG00306C MDL No:MFCD00496654
Product Description
Catalog Number:
AG00306C
Chemical Name:
Quinoline, 1,2,3,4-tetrahydro-7-nitro-
CAS Number:
30450-62-5
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
MDL Number:
MFCD00496654
IUPAC Name:
7-nitro-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C9H10N2O2/c12-11(13)8-4-3-7-2-1-5-10-9(7)6-8/h3-4,6,10H,1-2,5H2
InChI Key:
WSWMGHRLUYADNA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)NCCC2
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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