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Home > Other Building Blocks > 137215-27-1
137215-27-1 | 2H-1-Benzopyran-2-one, 7-mercapto-4-methyl-
CAS No: 137215-27-1 Catalog No: AG0012YF MDL No:
Product Description
Catalog Number:
AG0012YF
Chemical Name:
2H-1-Benzopyran-2-one, 7-mercapto-4-methyl-
CAS Number:
137215-27-1
Molecular Formula:
C10H8O2S
Molecular Weight:
192.2343
IUPAC Name:
4-methyl-7-sulfanylchromen-2-one
InChI:
InChI=1S/C10H8O2S/c1-6-4-10(11)12-9-5-7(13)2-3-8(6)9/h2-5,13H,1H3
InChI Key:
BYDNGJQDDNBAHI-UHFFFAOYSA-N
SMILES:
Sc1ccc2c(c1)oc(=O)cc2C
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.025g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.232g/mol
Monoisotopic Mass:
192.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| S-Glucuronidation of 7-mercapto-4-methylcoumarin by human UDP glycosyltransferases in genetically engineered fission yeast cells. | Biological chemistry 20111201 |
| New fluorescent zinc complexes: towards specific sensors for hydrogen sulfide in solution. | Dalton transactions (Cambridge, England : 2003) 20091114 |
| 7-mercapto-4-methylcoumarin as a reporter of thiol binding to the CdSe quantum dot surface. | Chemical communications (Cambridge, England) 20090614 |
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