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75786-75-3 | 2H-1-Benzopyran-2-one,4,6,7-trimethyl-
CAS No: 75786-75-3 Catalog No: AG0059ZN MDL No:
Product Description
Catalog Number:
AG0059ZN
Chemical Name:
2H-1-Benzopyran-2-one,4,6,7-trimethyl-
CAS Number:
75786-75-3
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
IUPAC Name:
4,6,7-trimethylchromen-2-one
InChI:
InChI=1S/C12H12O2/c1-7-4-10-9(3)6-12(13)14-11(10)5-8(7)2/h4-6H,1-3H3
InChI Key:
RYGXMOYSSBNDQZ-UHFFFAOYSA-N
SMILES:
O=c1cc(C)c2c(o1)cc(c(c2)C)C
NSC Number:
108431
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.226g/mol
Monoisotopic Mass:
188.084g/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
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