Basic information
- CAS
17677-15-5- Standard SMILES
CCCCCCCCCCCCOCC(O)CCl- InChIKey
BYAAUZDTUKVBDS-UHFFFAOYSA-N- Molecular formula
- C15H31ClO2
- Average molar mass
- 278.86 g/mol
- Monoisotopic mass
- 278.2012579
Names & identifiers
- Preferred name
- 2-Propanol, 1-chloro-3-(dodecyloxy)-
- IUPAC
- 1-chloro-3-dodecoxypropan-2-ol
- English name
- 1-chloro-3-(dodecyloxy)propan-2-ol
- Molecular formula
- C15H31ClO2
- Molecular weight
- 278.86
Names & synonyms
1-Chloro-3-(dodecyloxy)propan-2-ol17677-15-52-Propanol, 1-chloro-3-(dodecyloxy)-EINECS 241-661-7DTXSID40884982RefChem:478501DTXCID401024396241-661-71-chloro-3-dodecoxypropan-2-olSCHEMBL8958207BYAAUZDTUKVBDS-UHFFFAOYSA-NNS00053486
Show more names
Dodecylchlorhydrin ether1-Chloro-3-dodecyloxy-2-propanol
Database identifiers
- CAS
17677-15-5- PubChem CID
- 86606
- DTXSID
DTXSID40884982- EC Number
- 241-661-7
- Nikkaji
- J26.182C
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Boiling point
- 193 · 193-195 °C
- Density
- 0.9552 g/cm3 · 0.9552 g/cm3
- pka
- 13.27 · 13.27±0.20(Predicted)
- EPA Substance Registry System
- 2 · 2-Propanol, 1-chloro-3-(dodecyloxy)- (17677-15-5)
- TSCA
- TSCA listed
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 ClassificationNot Classified
Hazard information
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Propanol, 1-chloro-3-(dodecyloxy)-: INACTIVE
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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