Basic information
- CAS
100208-41-1- Standard SMILES
CC(C)OCOCO- InChIKey
LHCRFMIUQHIZLC-UHFFFAOYSA-N- Molecular formula
- C5H12O3
- Average molar mass
- 120.15 g/mol
- Monoisotopic mass
- 120.07864424
Names & identifiers
- Preferred name
- (Isopropoxymethoxy)methanol
- IUPAC
- propan-2-yloxymethoxymethanol
- English name
- (isopropoxymethoxy)methanol
- Molecular formula
- C5H12O3
- Molecular weight
- 120.15
Names & synonyms
(Isopropoxymethoxy)methanol100208-41-1propan-2-yloxymethoxymethanolEINECS 309-242-4DTXSID90143016LHCRFMIUQHIZLC-UHFFFAOYSA-N{[(Propan-2-yl)oxy]methoxy}methanolNS00065757[(1-Methylethoxy)methoxy]methanolMethanol, 1-[(1-methylethoxy)methoxy]-
Database identifiers
- CAS
100208-41-1- PubChem CID
- 113552
- DTXSID
DTXSID90143016- EC Number
- 309-242-4
- Nikkaji
- J333.791J
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 44.9
Physicochemical properties
- Boiling point
- 84.7 · 84.7±15.0 °C(Predicted)
- Density
- 0.987 · 0.987±0.06 g/cm3(Predicted)
- pka
- 12.85 · 12.85±0.10(Predicted)
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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