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157101-77-4 | 2H-1-Benzopyran-2-one, 7-hydroxy-4-(methoxymethyl)-
CAS No: 157101-77-4 Catalog No: AG001P8B MDL No:MFCD00052607
Product Description
Catalog Number:
AG001P8B
Chemical Name:
2H-1-Benzopyran-2-one, 7-hydroxy-4-(methoxymethyl)-
CAS Number:
157101-77-4
Molecular Formula:
C11H10O4
Molecular Weight:
206.1947
MDL Number:
MFCD00052607
IUPAC Name:
7-hydroxy-4-(methoxymethyl)chromen-2-one
InChI:
InChI=1S/C11H10O4/c1-14-6-7-4-11(13)15-10-5-8(12)2-3-9(7)10/h2-5,12H,6H2,1H3
InChI Key:
PRVOZGKAZHXKMM-UHFFFAOYSA-N
SMILES:
COCc1cc(=O)oc2c1ccc(c2)O
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.058g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.197g/mol
Monoisotopic Mass:
206.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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