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162012-71-7 | Quinazoline, 4,7-dichloro-6-nitro-
CAS No: 162012-71-7 Catalog No: AG001SML MDL No:MFCD15528783
Product Description
Catalog Number:
AG001SML
Chemical Name:
Quinazoline, 4,7-dichloro-6-nitro-
CAS Number:
162012-71-7
Molecular Formula:
C8H3Cl2N3O2
Molecular Weight:
244.0343
MDL Number:
MFCD15528783
IUPAC Name:
4,7-dichloro-6-nitroquinazoline
InChI:
InChI=1S/C8H3Cl2N3O2/c9-5-2-6-4(1-7(5)13(14)15)8(10)12-3-11-6/h1-3H
InChI Key:
VHFFODQAQLNACY-UHFFFAOYSA-N
SMILES:
Clc1ncnc2c1cc([N+](=O)[O-])c(c2)Cl
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.96g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.031g/mol
Monoisotopic Mass:
242.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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