| CAS Number | 872-38-8 |
| Catalog Number | AG004MN1(AGN-PC-005JRC) |
| Chemical Name | (3-Methyloxiran-2-Yl)Methanol |
| IUPAC Name | (3-methyloxiran-2-yl)methanol |
| InChI | InChI=1S/C4H8O2/c1-3-4(2-5)6-3/h3-5H,2H2,1H3 |
| InChI Key | QQHZNUPEBVRUFO-UHFFFAOYSA-N |
| MDL Number | MFCD00033455 |
| Molecular Formula | C4H8O2 |
| Molecular Weight | 88.1051 |
| NSC Number | 34457 |
| SMILES | OCC1OC1C |
| Synonyms | (3-methyloxiran-2-yl)methanol,
872-38-8,
(3-Methyl-oxiran-2-yl)-methanol,
NSC34457,
Oxiranemethanol, 3-methyl-, (2R,3S)-,
ACMC-20lvvs,
2,3-epoxybutan-1-ol,
3-Methyloxirane-2-methanol,
AC1L5SC7,
(3-methyl-oxiranyl)-methanol,
(3-Methyl-2-oxiranyl)methanol,
CTK5F8130,
QQHZNUPEBVRUFO-UHFFFAOYSA-N,
(3-Methyl-2-oxiranyl)methanol #,
92418-72-9,
NSC-34457,
CID234485,
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| Complexity | 53.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 88.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 6 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 88.106g/mol |
| Monoisotopic Mass | 88.052g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.8A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number