Home Halogens 6-chloro-7-fluoro-3,4-dihydro-2H-1-benzopyran-4-one

6-chloro-7-fluoro-3,4-dihydro-2H-1-benzopyran-4-one

CAS No.:
1092349-25-1
Catalog Number:
AG01B5AG
Molecular Formula:
C9H6ClFO2
Molecular Weight:
200.5941
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Product Description
Catalog Number:
AG01B5AG
Chemical Name:
6-chloro-7-fluoro-3,4-dihydro-2H-1-benzopyran-4-one
CAS Number:
1092349-25-1
Molecular Formula:
C9H6ClFO2
Molecular Weight:
200.5941
MDL Number:
MFCD11518440
IUPAC Name:
6-chloro-7-fluoro-2,3-dihydrochromen-4-one
InChI:
InChI=1S/C9H6ClFO2/c10-6-3-5-8(12)1-2-13-9(5)4-7(6)11/h3-4H,1-2H2
InChI Key:
NCJQKDQIJMTYJK-UHFFFAOYSA-N
SMILES:
O=C1CCOc2c1cc(Cl)c(c2)F
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.004g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.593g/mol
Monoisotopic Mass:
200.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties