Completing data — usually done within a minute
Basic information
- CAS
83190-45-8- Standard SMILES
CCOC(=O)C(C(C)C)C(C)C=C(Cl)Cl- InChIKey
ZXTDSOBNPPCKIJ-UHFFFAOYSA-N- Molecular formula
- C11H18Cl2O2
- Average molar mass
- 253.16 g/mol
- Monoisotopic mass
- 252.0683852
Names & identifiers
- Preferred name
- Ethyl 5,5-dichloro-3-methyl-2-propan-2-ylpent-4-enoate
- IUPAC
- ethyl 5,5-dichloro-3-methyl-2-propan-2-ylpent-4-enoate
Names & synonyms
83190-45-8ethyl 5,5-dichloro-3-methyl-2-propan-2-ylpent-4-enoateethyl 5,5-dichloro-3-methyl-2-isopropyl-4-pentenoateSCHEMBL10983894DTXSID50514041ZXTDSOBNPPCKIJ-UHFFFAOYSA-Nethyl 5,5-dichloro-2-isopropyl-3-methyl-4-pentenoateEthyl 5,5-dichloro-3-methyl-2-(propan-2-yl)pent-4-enoate5,5-Dichloro-2-isopropyl-3-methyl-pent-4-enoic acid ethyl ester
Database identifiers
- CAS
83190-45-8- PubChem CID
- 12959693
- DTXSID
DTXSID50514041
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 233
Related reactions
3 records
Compound notes
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