3,3-Dimethyloxolan-2-ol
Basic information
- CAS
102536-89-0- Standard SMILES
CC1(C)CCOC1O- InChIKey
DDRXTONTKHHZNX-UHFFFAOYSA-N- Molecular formula
- C6H12O2
- Average molar mass
- 116.16 g/mol
- Monoisotopic mass
- 116.08372962
Names & identifiers
- Preferred name
- 3,3-Dimethyloxolan-2-ol
- IUPAC
- 3,3-dimethyloxolan-2-ol
- English name
- 2-Furanol, tetrahydro-3,3-dimethyl-
- Molecular formula
- C6H12O2
- Molecular weight
- 116.16
Names & synonyms
3,3-dimethyloxolan-2-ol102536-89-0RefChem:485595835-121-53,3-DIMETHYLTETRAHYDRO-2-FURANOLSCHEMBL3387085SCHEMBL16385694EN300-67469012-Furanol, tetrahydro-3,3-dimethyl-
Database identifiers
- CAS
102536-89-0- PubChem CID
- 13616740
- EC Number
- 835-121-5
- Nikkaji
- J1.787.698H
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 88.5
Physicochemical properties
- Boiling point
- 80 · 80-90 °C(Press: 0.02 Torr)
- Density
- 1.008 · 1.008±0.06 g/cm3(Predicted)
- pka
- 13.25 · 13.25±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319-H227
- Precautionary statements
- 210 · P210-P280-P370+P378-P403+P235-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
Warning
H227 (100%): Combustible liquid [Warning Flammable liquids]
P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319-H227
- Precautionary statements
- P210-P280-P370+P378-P403+P235-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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