Basic information
- Standard SMILES
COCC(C)(C)C(=O)OCCl- InChIKey
HVZVGRJBAPGEJO-UHFFFAOYSA-N- Molecular formula
- C7H13ClO3
- Average molar mass
- 180.63 g/mol
- Monoisotopic mass
- 180.055322
Names & identifiers
- Preferred name
- 3-Methoxy-2,2-dimethylpropionic acid chloromethyl ester
- IUPAC
- chloromethyl 3-methoxy-2,2-dimethylpropanoate
Names & synonyms
3-methoxy-2,2-dimethylpropionic acid chloromethyl esterchloromethyl 3-methoxy-2,2-dimethylpropanoate1350552-00-9SCHEMBL2597476HVZVGRJBAPGEJO-UHFFFAOYSA-NA1-10057
Database identifiers
- PubChem CID
- 14459693
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 134
Related reactions
7 records
Compound notes
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