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Home > Other Building Blocks > 1217-93-2
1217-93-2 | 4H-1-Benzopyran-4-one, 6-methyl-3-phenyl-
CAS No: 1217-93-2 Catalog No: AG0015MB MDL No:
Product Description
Catalog Number:
AG0015MB
Chemical Name:
4H-1-Benzopyran-4-one, 6-methyl-3-phenyl-
CAS Number:
1217-93-2
Molecular Formula:
C16H12O2
Molecular Weight:
236.2653
IUPAC Name:
6-methyl-3-phenylchromen-4-one
InChI:
InChI=1S/C16H12O2/c1-11-7-8-15-13(9-11)16(17)14(10-18-15)12-5-3-2-4-6-12/h2-10H,1H3
InChI Key:
WPPSYROXFNGOGO-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(=O)c(co2)c1ccccc1
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.084g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.27g/mol
Monoisotopic Mass:
236.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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