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101860-71-3 | Quinoline, 3-chloro-6-nitro-
CAS No: 101860-71-3 Catalog No: AG0005RK MDL No:
Product Description
Catalog Number:
AG0005RK
Chemical Name:
Quinoline, 3-chloro-6-nitro-
CAS Number:
101860-71-3
Molecular Formula:
C9H5ClN2O2
Molecular Weight:
208.6012
IUPAC Name:
3-chloro-6-nitroquinoline
InChI:
InChI=1S/C9H5ClN2O2/c10-7-3-6-4-8(12(13)14)1-2-9(6)11-5-7/h1-5H
InChI Key:
VVOLFJPSMUMGAT-UHFFFAOYSA-N
SMILES:
Clc1cnc2c(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:
208.004g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.601g/mol
Monoisotopic Mass:
208.004g/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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