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1802820-05-8 | 3-Iodo-6-nitroquinoline
CAS No: 1802820-05-8 Catalog No: AG00I00Y MDL No:MFCD26131161
Product Description
Catalog Number:
AG00I00Y
Chemical Name:
3-Iodo-6-nitroquinoline
CAS Number:
1802820-05-8
Molecular Formula:
C9H5IN2O2
Molecular Weight:
300.0527
MDL Number:
MFCD26131161
IUPAC Name:
3-iodo-6-nitroquinoline
InChI:
InChI=1S/C9H5IN2O2/c10-7-3-6-4-8(12(13)14)1-2-9(6)11-5-7/h1-5H
InChI Key:
UUYQWISZDVXBND-UHFFFAOYSA-N
SMILES:
Ic1cnc2c(c1)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.94g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.055g/mol
Monoisotopic Mass:
299.94g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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