Home Halogens 6-chloro-2-(difluoromethyl)quinazolin-4-ol

6-chloro-2-(difluoromethyl)quinazolin-4-ol

CAS No.:
50419-38-0
Catalog Number:
AG01BB1A
Molecular Formula:
C9H5ClF2N2O
Molecular Weight:
230.5986
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Product Description
Catalog Number:
AG01BB1A
Chemical Name:
6-chloro-2-(difluoromethyl)quinazolin-4-ol
CAS Number:
50419-38-0
Molecular Formula:
C9H5ClF2N2O
Molecular Weight:
230.5986
MDL Number:
MFCD28714552
IUPAC Name:
6-chloro-2-(difluoromethyl)-3H-quinazolin-4-one
InChI:
InChI=1S/C9H5ClF2N2O/c10-4-1-2-6-5(3-4)9(15)14-8(13-6)7(11)12/h1-3,7H,(H,13,14,15)
InChI Key:
ZOJNZBCZKVYAFX-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c(O)nc(n2)C(F)F
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.006g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.599g/mol
Monoisotopic Mass:
230.006g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties