Home Halogens Quinazoline, 4-chloro-7-fluoro-6-methoxy-

Quinazoline, 4-chloro-7-fluoro-6-methoxy-

CAS No.:
159768-48-6
Catalog Number:
AG001RDB
Molecular Formula:
C9H6ClFN2O
Molecular Weight:
212.6081
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Product Description
Catalog Number:
AG001RDB
Chemical Name:
Quinazoline, 4-chloro-7-fluoro-6-methoxy-
CAS Number:
159768-48-6
Molecular Formula:
C9H6ClFN2O
Molecular Weight:
212.6081
MDL Number:
MFCD08234562
IUPAC Name:
4-chloro-7-fluoro-6-methoxyquinazoline
InChI:
InChI=1S/C9H6ClFN2O/c1-14-8-2-5-7(3-6(8)11)12-4-13-9(5)10/h2-4H,1H3
InChI Key:
XVFCYYAFOCEJSI-UHFFFAOYSA-N
SMILES:
COc1cc2c(Cl)ncnc2cc1F
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.608g/mol
Monoisotopic Mass:
212.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties