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174566-15-5 | Quinazoline, 2,4-dichloro-7-fluoro-
CAS No: 174566-15-5 Catalog No: AG001ZS2 MDL No:MFCD09954885
Product Description
Catalog Number:
AG001ZS2
Chemical Name:
Quinazoline, 2,4-dichloro-7-fluoro-
CAS Number:
174566-15-5
Molecular Formula:
C8H3Cl2FN2
Molecular Weight:
217.0272
MDL Number:
MFCD09954885
IUPAC Name:
2,4-dichloro-7-fluoroquinazoline
InChI:
InChI=1S/C8H3Cl2FN2/c9-7-5-2-1-4(11)3-6(5)12-8(10)13-7/h1-3H
InChI Key:
HHGKYNUUYMRIAV-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)nc(nc2Cl)Cl
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.966g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.024g/mol
Monoisotopic Mass:
215.966g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| 2,4-Dichloro-7-fluoro-quinazoline. | Acta crystallographica. Section E, Structure reports online 20120301 |
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