Basic information
- CAS
5394-08-1- Standard SMILES
C=C(Cl)COC(=O)C(C)O- InChIKey
CBIBRFIMMPMUTK-UHFFFAOYSA-N- Molecular formula
- C6H9ClO3
- Average molar mass
- 164.59 g/mol
- Monoisotopic mass
- 164.0240218
Names & identifiers
- Preferred name
- Lactic acid, 2-chloroallyl ester
- IUPAC
- 2-chloroprop-2-enyl 2-hydroxypropanoate
Names & synonyms
2-Chloroallyl lactateLactic acid, 2-chloroallyl ester5394-08-1NSC 2894BRN 1704743Propanoic acid, 2-hydroxy-, 2-chloro-2-propenyl ester3-03-00-00486 (Beilstein Handbook Reference)RefChem:351046Propanoic acid, 2-hydroxy-, 2-chloro-2-propenyl ester (9CI)WLN: QY1&VO1YGU1NSC2894DTXSID101339657
Show more names
NSC-2894Propanoic acid, 2-chloro-2-propenyl ester
Database identifiers
- CAS
5394-08-1- PubChem CID
- 95344
- DTXSID
DTXSID101339657- Nikkaji
- J41.586C
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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