methyl (Z)-4-(ethylamino)-4-oxobut-2-enoate
Basic information
- CAS
119074-43-0- Standard SMILES
CCNC(=O)/C=C\C(=O)OC- InChIKey
GYKIRBDPNRCHNO-PLNGDYQASA-N- Molecular formula
- C7H11NO3
- Average molar mass
- 157.17 g/mol
- Monoisotopic mass
- 157.07389321
Names & identifiers
- Preferred name
- methyl (Z)-4-(ethylamino)-4-oxobut-2-enoate
- IUPAC
- methyl (Z)-4-(ethylamino)-4-oxobut-2-enoate
Names & synonyms
methyl (Z)-4-(ethylamino)-4-oxobut-2-enoate119074-43-0SCHEMBL11529751But-2-enoic acid, 4-(ethylamino)-4-oxo-, methyl ester, (Z)-
Database identifiers
- CAS
119074-43-0- PubChem CID
- 6443387
- Nikkaji
- J829.053I
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 175
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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