(3R)-3-(2,2-dimethoxyethyl)-4-methylpent-4-enoic acid
Basic information
- CAS
188568-04-9- Standard SMILES
C=C(C)[C@@H](CC(=O)O)CC(OC)OC- InChIKey
SDDZKRUSDXISBS-QMMMGPOBSA-N- Molecular formula
- C10H18O4
- Average molar mass
- 202.25 g/mol
- Monoisotopic mass
- 202.12050905
Names & identifiers
- Preferred name
- (3R)-3-(2,2-dimethoxyethyl)-4-methylpent-4-enoic acid
- IUPAC
- (3R)-3-(2,2-dimethoxyethyl)-4-methylpent-4-enoic acid
Names & synonyms
188568-04-9CTK0E1944(3R)-3-(2,2-dimethoxyethyl)-4-methylpent-4-enoic acidDTXSID60462983
Database identifiers
- CAS
188568-04-9- PubChem CID
- 11344697
- DTXSID
DTXSID60462983- Nikkaji
- J852.724E
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 196
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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