Basic information
- CAS
2037-00-5- Standard SMILES
CCN(CC)COC(C)=O- InChIKey
HRFPFWMWWNVACI-UHFFFAOYSA-N- Molecular formula
- C7H15NO2
- Average molar mass
- 145.2 g/mol
- Monoisotopic mass
- 145.11027872
Names & identifiers
- Preferred name
- Acetic acid, N,N-diethylaminomethyl ester
- IUPAC
- diethylaminomethyl acetate
- English name
- (Diethylamino)methyl=acetate
- Molecular formula
- C7H15NO2
- Molecular weight
- 145.2
Names & synonyms
N,N-DiethylaminomethylacetateACETIC ACID, N,N-DIETHYLAMINOMETHYL ESTER2037-00-5N,N-DiaethylaminomethylessigsaeureesterNSC 157703BRN 1750624Acetic acid, N,N-(diethylamino)methyl esterN,N-Diaethylaminomethylessigsaeureester [German]DTXSID801742980-04-00-00106 (Beilstein Handbook Reference)RefChem:316653Methanol, (diethylamino)-, acetate (ester) (8CI)
Show more names
Methanol, 1-(diethylamino)-, 1-acetate
DTXCID9096789Methanol, (diethylamino)-, acetate (ester) (8CI)(9CI)diethylaminomethyl acetateX4HG7G8X2SMethanol, (diethylamino)-, acetate (ester)NSC-157703(diethylamino)methyl acetate(Diethylamino)methyl=acetate
Database identifiers
- CAS
2037-00-5- PubChem CID
- 16256
- DTXSID
DTXSID80174298- UNII
- X4HG7G8X2S
- Nikkaji
- J54.206G
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 99.8
Physicochemical properties
- FDA UNII
- 4 HG7G8X2S · X4HG7G8X2S
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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