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Home > Other Building Blocks > 23000-33-1
23000-33-1 | 2H-1-Benzopyran-2-one, 3-(4-methoxyphenyl)-
CAS No: 23000-33-1 Catalog No: AG002LTC MDL No:
Product Description
Catalog Number:
AG002LTC
Chemical Name:
2H-1-Benzopyran-2-one, 3-(4-methoxyphenyl)-
CAS Number:
23000-33-1
Molecular Formula:
C16H12O3
Molecular Weight:
252.2647
IUPAC Name:
3-(4-methoxyphenyl)chromen-2-one
InChI:
InChI=1S/C16H12O3/c1-18-13-8-6-11(7-9-13)14-10-12-4-2-3-5-15(12)19-16(14)17/h2-10H,1H3
InChI Key:
LDECIIDIVZISJV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cc2ccccc2oc1=O
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.079g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.269g/mol
Monoisotopic Mass:
252.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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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