CAS 72657-23-9 | Methyl (R)-(-)-3-hydroxy-2-methylpropionate | CAS Number 72657-23-9

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72657-23-9 | Methyl (R)-(-)-3-hydroxy-2-methylpropionate

CAS No: 72657-23-9 Catalog No: AG003553 MDL No:MFCD00063450

Product Description

Catalog Number:

AG003553

Chemical Name:

Methyl (R)-(-)-3-hydroxy-2-methylpropionate

CAS Number:

72657-23-9

Molecular Formula:

C5H10O3

Molecular Weight:

118.1311

MDL Number:

MFCD00063450

IUPAC Name:

methyl (2R)-3-hydroxy-2-methylpropanoate

InChI:

InChI=1S/C5H10O3/c1-4(3-6)5(7)8-2/h4,6H,3H2,1-2H3/t4-/m1/s1

InChI Key:

ATCCIZURPPEVIZ-SCSAIBSYSA-N

SMILES:

C[C@@H](C(=O)OC)CO

Properties

Complexity:

79.7

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

118.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

118.132g/mol

Monoisotopic Mass:

118.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.1

Literature

Title	Journal
The first enantioselective synthesis of palinurin.	Chemical communications (Cambridge, England) 20090614
13-Methyl-substituted des-C,D analogs of (20S)-1alpha,25-dihydroxy-2-methylene-19-norvitamin D3 (2MD): synthesis and biological evaluation.	Bioorganic & medicinal chemistry 20090215