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497084-46-5 | 3-Iodo-8-nitro-quinoline
CAS No: 497084-46-5 Catalog No: AG00DGFS MDL No:MFCD09261162
Product Description
Catalog Number:
AG00DGFS
Chemical Name:
3-Iodo-8-nitro-quinoline
CAS Number:
497084-46-5
Molecular Formula:
C9H5IN2O2
Molecular Weight:
300.0527
MDL Number:
MFCD09261162
IUPAC Name:
3-iodo-8-nitroquinoline
InChI:
InChI=1S/C9H5IN2O2/c10-7-4-6-2-1-3-8(12(13)14)9(6)11-5-7/h1-5H
InChI Key:
JTOBADNVHAZTAP-UHFFFAOYSA-N
SMILES:
Ic1cnc2c(c1)cccc2[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:
2.1
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