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883-09-0 | 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2,2-dimethyl-
CAS No: 883-09-0 Catalog No: AG00486A MDL No:MFCD02066217
Product Description
Catalog Number:
AG00486A
Chemical Name:
4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2,2-dimethyl-
CAS Number:
883-09-0
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
MDL Number:
MFCD02066217
IUPAC Name:
5,7-dihydroxy-2,2-dimethyl-3H-chromen-4-one
InChI:
InChI=1S/C11H12O4/c1-11(2)5-8(14)10-7(13)3-6(12)4-9(10)15-11/h3-4,12-13H,5H2,1-2H3
InChI Key:
JFWGYKRUMPKNKF-UHFFFAOYSA-N
SMILES:
Oc1cc2OC(C)(C)CC(=O)c2c(c1)O
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.213g/mol
Monoisotopic Mass:
208.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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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