Home Halogens 7-bromo-6-methyl-3,4-dihydro-2H-1-benzopyran-4-one

7-bromo-6-methyl-3,4-dihydro-2H-1-benzopyran-4-one

CAS No.:
1273604-53-7
Catalog Number:
AG01EL7Z
Molecular Formula:
C10H9BrO2
Molecular Weight:
241.0813
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Product Description
Catalog Number:
AG01EL7Z
Chemical Name:
7-bromo-6-methyl-3,4-dihydro-2H-1-benzopyran-4-one
CAS Number:
1273604-53-7
Molecular Formula:
C10H9BrO2
Molecular Weight:
241.0813
MDL Number:
MFCD18648664
IUPAC Name:
7-bromo-6-methyl-2,3-dihydrochromen-4-one
InChI:
InChI=1S/C10H9BrO2/c1-6-4-7-9(12)2-3-13-10(7)5-8(6)11/h4-5H,2-3H2,1H3
InChI Key:
QHMGUUVXVCGCLI-UHFFFAOYSA-N
SMILES:
O=C1CCOc2c1cc(C)c(c2)Br
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.979g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.084g/mol
Monoisotopic Mass:
239.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties