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1160994-83-1 | Quinazoline, 2,4-dichloro-7-(trifluoromethoxy)-
CAS No: 1160994-83-1 Catalog No: AG000BMT MDL No:MFCD12400771
Product Description
Catalog Number:
AG000BMT
Chemical Name:
Quinazoline, 2,4-dichloro-7-(trifluoromethoxy)-
CAS Number:
1160994-83-1
Molecular Formula:
C9H3Cl2F3N2O
Molecular Weight:
283.0341
MDL Number:
MFCD12400771
IUPAC Name:
2,4-dichloro-7-(trifluoromethoxy)quinazoline
InChI:
InChI=1S/C9H3Cl2F3N2O/c10-7-5-2-1-4(17-9(12,13)14)3-6(5)15-8(11)16-7/h1-3H
InChI Key:
JKYSFPLAGCMMOI-UHFFFAOYSA-N
SMILES:
Clc1nc(Cl)c2c(n1)cc(cc2)OC(F)(F)F
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.957g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.031g/mol
Monoisotopic Mass:
281.957g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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