(3-Methyloxiran-2-yl)methanol
Basic information
- CAS
872-38-8- Standard SMILES
CC1OC1CO- InChIKey
QQHZNUPEBVRUFO-UHFFFAOYSA-N- Molecular formula
- C4H8O2
- Average molar mass
- 88.11 g/mol
- Monoisotopic mass
- 88.05242949
Names & identifiers
- Preferred name
- (3-Methyloxiran-2-yl)methanol
- IUPAC
- (3-methyloxiran-2-yl)methanol
Names & synonyms
(3-methyloxiran-2-yl)methanol872-38-8DTXSID401007398RefChem:400442DTXCID70850559822-626-0(3-Methyl-oxiran-2-yl)-methanol2,3-epoxybutanol2,3-epoxybutan-1-olMFCD000334553-Methyl-2-oxiranemethanol; (3-Methyloxiran-2-yl)methanol; 2,3-Epoxy-1-butanol; 3-Methyloxiranemethanol; NSC 34457;NSC34457
Show more names
SCHEMBL512132-Oxiranemethanol,3-methyl-(3-Methyl-2-oxiranyl)methanolorb3144422SCHEMBL3731462QQHZNUPEBVRUFO-UHFFFAOYSA-N(3-Methyl-2-oxiranyl)methanol #NSC-34457
Database identifiers
- CAS
872-38-8- PubChem CID
- 234485
- DTXSID
DTXSID401007398- EC Number
- 822-626-0
- Nikkaji
- J790.484C
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 53.5
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H227 (50%): Combustible liquid [Warning Flammable liquids]
P203, P210, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 4 (50%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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