1-Chloro-3-(2-methylbut-3-yn-2-yloxy)propan-2-ol
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Basic information
- CAS
7312-49-4- Standard SMILES
C#CC(C)(C)OCC(O)CCl- InChIKey
ZSDIGBOJTLYGFB-UHFFFAOYSA-N- Molecular formula
- C8H13ClO2
- Average molar mass
- 176.64 g/mol
- Monoisotopic mass
- 176.0604073
Names & identifiers
- Preferred name
- 1-Chloro-3-(2-methylbut-3-yn-2-yloxy)propan-2-ol
- IUPAC
- 1-chloro-3-(2-methylbut-3-yn-2-yloxy)propan-2-ol
- English name
- 1-chloro-3-(2-methylbut-3-yn-2-yloxy)propan-2-ol
- Molecular formula
- C8H13ClO2
- Molecular weight
- 0
Names & synonyms
7312-49-41-chloro-3-(2-methylbut-3-yn-2-yloxy)propan-2-ol1-chloro-3-[(2-methylbut-3-yn-2-yl)oxy]propan-2-olNSC153430DTXSID00302778ZSDIGBOJTLYGFB-UHFFFAOYSA-NNSC-1534302-Propanol,1-dimethyl-2-propynyl)oxy]-
Database identifiers
- CAS
7312-49-4- PubChem CID
- 290309
- DTXSID
DTXSID00302778- Nikkaji
- J35.935A
Properties
Computed structural propertiesFilling in
- XLogP
- 0.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 157
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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