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131922-15-1 | Ethanone, 1-(2-benzofuranyl)-2,2-dihydroxy-
CAS No: 131922-15-1 Catalog No: AG000ZWN MDL No:MFCD05864644
Product Description
Catalog Number:
AG000ZWN
Chemical Name:
Ethanone, 1-(2-benzofuranyl)-2,2-dihydroxy-
CAS Number:
131922-15-1
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
MDL Number:
MFCD05864644
IUPAC Name:
2-(1-benzofuran-2-yl)-2-oxoacetaldehyde;hydrate
InChI:
InChI=1S/C10H6O3.H2O/c11-6-8(12)10-5-7-3-1-2-4-9(7)13-10;/h1-6H;1H2
InChI Key:
JVZHUDOMODCNLO-UHFFFAOYSA-N
SMILES:
OC(C(=O)c1cc2c(o1)cccc2)O
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.042g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.17g/mol
Monoisotopic Mass:
192.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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