Home Nitros 3-nitro-5,6,7,8-tetrahydroquinoline

3-nitro-5,6,7,8-tetrahydroquinoline

CAS No.:
84531-35-1
Catalog Number:
AG00GABI
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
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Product Description
Catalog Number:
AG00GABI
Chemical Name:
3-nitro-5,6,7,8-tetrahydroquinoline
CAS Number:
84531-35-1
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
MDL Number:
MFCD15527169
IUPAC Name:
3-nitro-5,6,7,8-tetrahydroquinoline
InChI:
InChI=1S/C9H10N2O2/c12-11(13)8-5-7-3-1-2-4-9(7)10-6-8/h5-6H,1-4H2
InChI Key:
HBFBJEXFVBHLIC-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc2c(c1)CCCC2
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:
0
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties