Methyl 2-(hexanoylamino)acetate
Basic information
- CAS
31295-09-7- Standard SMILES
CCCCCC(=O)NCC(=O)OC- InChIKey
ALDGTFMBPHWBRK-UHFFFAOYSA-N- Molecular formula
- C9H17NO3
- Average molar mass
- 187.24 g/mol
- Monoisotopic mass
- 187.1208434
Names & identifiers
- Preferred name
- Methyl 2-(hexanoylamino)acetate
- IUPAC
- methyl 2-(hexanoylamino)acetate
Names & synonyms
NSC359574AKOS009147089NSC-35957431295-09-7methyl 2-(hexanoylamino)acetateAC1L7ND8Methyl N-hexanoylglycinaten-Hexanoylglycine, methyl esterDTXSID10320448ALDGTFMBPHWBRK-UHFFFAOYSA-N
Database identifiers
- CAS
31295-09-7- PubChem CID
- 338209
- DTXSID
DTXSID10320448- Nikkaji
- J3.082.580B
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 168
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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