2-chloro-N-[2-(1-hydroxyethyl)-6-methylphenyl]-N-(1-hydroxypropan-2-yl)acetamide
Basic information
- CAS
96394-95-5- Standard SMILES
Cc1cccc(C(C)O)c1N(C(=O)CCl)C(C)CO- InChIKey
CZABLDSDDUXPSQ-UHFFFAOYSA-N- Molecular formula
- C14H20ClNO3
- Average molar mass
- 285.76 g/mol
- Monoisotopic mass
- 285.1131712
Names & identifiers
- Preferred name
- 2-chloro-N-[2-(1-hydroxyethyl)-6-methylphenyl]-N-(1-hydroxypropan-2-yl)acetamide
- IUPAC
- 2-chloro-N-[2-(1-hydroxyethyl)-6-methylphenyl]-N-(1-hydroxypropan-2-yl)acetamide
Names & synonyms
96394-95-52-chloro-N-[2-(1-hydroxyethyl)-6-methylphenyl]-N-(1-hydroxypropan-2-yl)acetamideDTXSID70914544Acetamide, 2-chloro-N-(2-(1-hydroxyethyl)-6-methylphenyl)-N-(2-hydroxy-1-methylethyl)-
Database identifiers
- CAS
96394-95-5- PubChem CID
- 180697
- DTXSID
DTXSID70914544
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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