Basic information
- CAS
148859-52-3- Standard SMILES
O=C(OCCCl)c1c(O)ccc2ccccc12- InChIKey
PRGBDEHVWNGVSZ-UHFFFAOYSA-N- Molecular formula
- C13H11ClO3
- Average molar mass
- 250.68 g/mol
- Monoisotopic mass
- 250.0396719
Names & identifiers
- Preferred name
- 2-Chloroethyl 2-hydroxy-1-naphthalenecarboxylate
- IUPAC
- 2-chloroethyl 2-hydroxynaphthalene-1-carboxylate
Names & synonyms
DTXSID7012357542-Chloroethyl 2-hydroxy-1-naphthalenecarboxylate2-Chloroethyl 2-hydroxynaphthalene-1-carboxylate148859-52-3
Database identifiers
- CAS
148859-52-3- PubChem CID
- 85691970
- DTXSID
DTXSID701235754
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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