Home Halogens 5,8-dichloro-3,4-dihydro-2H-1-benzopyran-4-one

5,8-dichloro-3,4-dihydro-2H-1-benzopyran-4-one

CAS No.:
22406-36-6
Catalog Number:
AG01A8E3
Molecular Formula:
C9H6Cl2O2
Molecular Weight:
217.0487
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Product Description
Catalog Number:
AG01A8E3
Chemical Name:
5,8-dichloro-3,4-dihydro-2H-1-benzopyran-4-one
CAS Number:
22406-36-6
Molecular Formula:
C9H6Cl2O2
Molecular Weight:
217.0487
MDL Number:
MFCD00956375
IUPAC Name:
5,8-dichloro-2,3-dihydrochromen-4-one
InChI:
InChI=1S/C9H6Cl2O2/c10-5-1-2-6(11)9-8(5)7(12)3-4-13-9/h1-2H,3-4H2
InChI Key:
LYBJCESWEFSPNO-UHFFFAOYSA-N
SMILES:
O=C1CCOc2c1c(Cl)ccc2Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.974g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.045g/mol
Monoisotopic Mass:
215.974g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties