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106323-73-3 | 4-Oxazolemethanol, 4,5-dihydro-
CAS No: 106323-73-3 Catalog No: AG007D0H MDL No:
Product Description
Catalog Number:
AG007D0H
Chemical Name:
4-Oxazolemethanol, 4,5-dihydro-
CAS Number:
106323-73-3
Molecular Formula:
C4H7NO2
Molecular Weight:
101.1039
IUPAC Name:
4,5-dihydro-1,3-oxazol-4-ylmethanol
InChI:
InChI=1S/C4H7NO2/c6-1-4-2-7-3-5-4/h3-4,6H,1-2H2
InChI Key:
UHUALVWZYFNZSF-UHFFFAOYSA-N
SMILES:
OCC1COC=N1
Properties
Complexity:
81.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
101.048g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
101.105g/mol
Monoisotopic Mass:
101.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
Literature
| Title | Journal |
|---|---|
| Exploring alternative Zn-binding groups in the design of HDAC inhibitors: squaric acid, N-hydroxyurea, and oxazoline analogues of SAHA. | Bioorganic & medicinal chemistry letters 20060915 |
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