2-[(2-Chloroprop-2-en-1-yl)(ethyl)amino]ethan-1-ol
Basic information
- CAS
89796-42-9- Standard SMILES
C=C(Cl)CN(CC)CCO- InChIKey
YSQYDHTYLOSHTF-UHFFFAOYSA-N- Molecular formula
- C7H14ClNO
- Average molar mass
- 163.64 g/mol
- Monoisotopic mass
- 163.0763918
Names & identifiers
- Preferred name
- 2-[(2-Chloroprop-2-en-1-yl)(ethyl)amino]ethan-1-ol
- IUPAC
- 2-[2-chloroprop-2-enyl(ethyl)amino]ethanol
Names & synonyms
89796-42-9NSC68636NCIOpen2_0006032-[(2-Chloroprop-2-en-1-yl)(ethyl)amino]ethan-1-olDTXSID80290442NSC-68636AKOS009063509
Database identifiers
- CAS
89796-42-9- PubChem CID
- 249873
- DTXSID
DTXSID80290442
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 106
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Compound notes
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