CAS 121843-07-0 | 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-methyl-, (4R,6R)- | CAS Number 121843-07-0

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121843-07-0 | 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-methyl-, (4R,6R)-

CAS No: 121843-07-0 Catalog No: AG00163Y MDL No:

Product Description

Catalog Number:

AG00163Y

Chemical Name:

2H-Pyran-2-one, tetrahydro-4-hydroxy-6-methyl-, (4R,6R)-

CAS Number:

121843-07-0

Molecular Formula:

C6H10O3

Molecular Weight:

130.1418

IUPAC Name:

4-hydroxy-6-methyloxan-2-one

InChI:

InChI=1S/C6H10O3/c1-4-2-5(7)3-6(8)9-4/h4-5,7H,2-3H2,1H3

InChI Key:

KKZQBMBBMJKIRQ-UHFFFAOYSA-N

SMILES:

O[C@@H]1C[C@@H](C)OC(=O)C1

NSC Number:

48106

Properties

Complexity:

122

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

130.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

130.143g/mol

Monoisotopic Mass:

130.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Synthesis and biological evaluation of (+/-)-dinemasone C and analogues.	The Journal of organic chemistry 20100903
New glycosides from the Japanese fern Hymenophyllum barbatum.	Chemical & pharmaceutical bulletin 20020401
New bitter-tasting hemiterpene glycosides from the Japanese fern Hymenophyllum barbatum.	Chemical & pharmaceutical bulletin 20011201