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1197199-75-9 | Quinazoline, 4-chloro-7-(4-fluorophenyl)-
CAS No: 1197199-75-9 Catalog No: AG000PJN MDL No:
Product Description
Catalog Number:
AG000PJN
Chemical Name:
Quinazoline, 4-chloro-7-(4-fluorophenyl)-
CAS Number:
1197199-75-9
Molecular Formula:
C14H8ClFN2
Molecular Weight:
258.6781
IUPAC Name:
4-chloro-7-(4-fluorophenyl)quinazoline
InChI:
InChI=1S/C14H8ClFN2/c15-14-12-6-3-10(7-13(12)17-8-18-14)9-1-4-11(16)5-2-9/h1-8H
InChI Key:
ZYOSNGKDFMYVJH-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1ccc2c(c1)ncnc2Cl
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.036g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.68g/mol
Monoisotopic Mass:
258.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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