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156006-10-9 | 2H-1-Benzopyran-2-one, 3,4-dimethyl-7-(2-oxopropoxy)-
CAS No: 156006-10-9 Catalog No: AG001OGE MDL No:MFCD01880897
Product Description
Catalog Number:
AG001OGE
Chemical Name:
2H-1-Benzopyran-2-one, 3,4-dimethyl-7-(2-oxopropoxy)-
CAS Number:
156006-10-9
Molecular Formula:
C14H14O4
Molecular Weight:
246.2586
MDL Number:
MFCD01880897
IUPAC Name:
3,4-dimethyl-7-(2-oxopropoxy)chromen-2-one
InChI:
InChI=1S/C14H14O4/c1-8(15)7-17-11-4-5-12-9(2)10(3)14(16)18-13(12)6-11/h4-6H,7H2,1-3H3
InChI Key:
GWDJHHFMPSBOKF-UHFFFAOYSA-N
SMILES:
CC(=O)COc1ccc2c(c1)oc(=O)c(c2C)C
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.089g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.262g/mol
Monoisotopic Mass:
246.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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