1-Aziridineacetic acid, 2-methyl-3-(1-methylethyl)-, ethyl ester, trans-
Basic information
- CAS
55669-84-6- Standard SMILES
CCOC(=O)CN1C(C)C1C(C)C- InChIKey
WJIKQZLTSPXKBX-UHFFFAOYSA-N- Molecular formula
- C10H19NO2
- Average molar mass
- 185.26 g/mol
- Monoisotopic mass
- 185.14157885
Names & identifiers
- Preferred name
- 1-Aziridineacetic acid, 2-methyl-3-(1-methylethyl)-, ethyl ester, trans-
- IUPAC
- ethyl 2-(2-methyl-3-propan-2-ylaziridin-1-yl)acetate
Names & synonyms
55669-84-6NSC148261DTXSID60971020WJIKQZLTSPXKBX-UHFFFAOYSA-N1-Aziridineacetic acid, 2-methyl-3-(1-methylethyl)-, ethyl ester, trans-NSC-1482611-Aziridineacetic acid, ethyl ester, trans-Ethyl (2-isopropyl-3-methyl-1-aziridinyl)acetate #ethyl [2-methyl-3-(propan-2-yl)aziridin-1-yl]acetate
Database identifiers
- CAS
55669-84-6- PubChem CID
- 287979
- DTXSID
DTXSID60971020
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 191
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Related reactions
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Compound notes
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