2-Propanol, 1-(2-butynyloxy)-3-chloro-
Basic information
- CAS
42468-66-6- Standard SMILES
CC#CCOCC(O)CCl- InChIKey
FICOWEDDVFGKJL-UHFFFAOYSA-N- Molecular formula
- C7H11ClO2
- Average molar mass
- 162.61 g/mol
- Monoisotopic mass
- 162.0447573
Names & identifiers
- Preferred name
- 2-Propanol, 1-(2-butynyloxy)-3-chloro-
- IUPAC
- 1-but-2-ynoxy-3-chloropropan-2-ol
Names & synonyms
2-Propanol, 1-(2-butynyloxy)-3-chloro-42468-66-6NSC-153429NSC153429P63MQ8EG3FSCHEMBL11597347AKOS0063879151-(2-Butyn-1-yloxy)-3-chloro-2-propanol2-Propanol, 1-(2-butyn-1-yloxy)-3-chloro-
Database identifiers
- CAS
42468-66-6- PubChem CID
- 290308
- UNII
- P63MQ8EG3F
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 133
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…