Basic information
- CAS
70096-86-5- Standard SMILES
C=C(C)C(C(=O)OC)N(CC)CC- InChIKey
OQSYMKVWRZTWAX-UHFFFAOYSA-N- Molecular formula
- C10H19NO2
- Average molar mass
- 185.26 g/mol
- Monoisotopic mass
- 185.14157885
Names & identifiers
- Preferred name
- 3-Butenoic acid, 2-(diethylamino)-3-methyl-, methyl ester
- IUPAC
- methyl 2-(diethylamino)-3-methylbut-3-enoate
Names & synonyms
70096-86-5DTXSID503423413-Butenoic acid, 2-(diethylamino)-3-methyl-, methyl esterRefChem:277897DTXCID10293421Methyl 2-diethylamino-3-methyl-but-3-enoatemethyl 2-(diethylamino)-3-methylbut-3-enoateMethyl 2-(diethylamino)-3-methyl-3-butenoate #
Database identifiers
- CAS
70096-86-5- PubChem CID
- 580976
- DTXSID
DTXSID50342341
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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