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57044-25-4 | (R)-Oxiran-2-ylmethanol
CAS No: 57044-25-4 Catalog No: AG0038N1 MDL No:MFCD00074873
Product Description
Catalog Number:
AG0038N1
Chemical Name:
(R)-Oxiran-2-ylmethanol
CAS Number:
57044-25-4
Molecular Formula:
C3H6O2
Molecular Weight:
74.0785
MDL Number:
MFCD00074873
IUPAC Name:
[(2R)-oxiran-2-yl]methanol
InChI:
InChI=1S/C3H6O2/c4-1-3-2-5-3/h3-4H,1-2H2/t3-/m1/s1
InChI Key:
CTKINSOISVBQLD-GSVOUGTGSA-N
SMILES:
OC[C@@H]1CO1
EC Number:
404-660-4
Properties
Complexity:
35.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
74.037g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
74.079g/mol
Monoisotopic Mass:
74.037g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
Literature
| Title | Journal |
|---|---|
| Total synthesis of (+)-intricarene using a biogenetically patterned pathway from (-)-bipinnatin J, involving a novel transannular [5+2] (1,3-dipolar) cycloaddition. | Organic & biomolecular chemistry 20091107 |
| Synthesis of novel ketoconazole derivatives as inhibitors of the human Pregnane X Receptor (PXR; NR1I2; also termed SXR, PAR). | Bioorganic & medicinal chemistry letters 20080715 |
| Characterization of a novel enantioselective halohydrin hydrogen-halide-lyase. | Applied and environmental microbiology 19940401 |
| Resolution and some properties of enzymes involved in enantioselective transformation of 1,3-dichloro-2-propanol to (R)-3-chloro-1,2-propanediol by Corynebacterium sp. strain N-1074. | Journal of bacteriology 19921201 |
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