Basic information
- CAS
13057-81-3- Standard SMILES
CCOC(=O)N(CO)COC- InChIKey
YXPVEMOMGTYXHU-UHFFFAOYSA-N- Molecular formula
- C6H13NO4
- Average molar mass
- 163.17 g/mol
- Monoisotopic mass
- 163.0844579
Names & identifiers
- Preferred name
- Ethyl (hydroxymethyl)(methoxymethyl)carbamate
- IUPAC
- ethyl N-(hydroxymethyl)-N-(methoxymethyl)carbamate
- English name
- ethyl (hydroxymethyl)(methoxymethyl)carbamate
- Molecular formula
- C6H13NO4
- Molecular weight
- 163.17
Names & synonyms
Ethyl (hydroxymethyl)(methoxymethyl)carbamate13057-81-3ethyl N-(hydroxymethyl)-N-(methoxymethyl)carbamateEINECS 235-947-04VKM3WL4SLDTXSID10156628YXPVEMOMGTYXHU-UHFFFAOYSA-NNS00024114Carbamic acid, (hydroxymethyl)(methoxymethyl)-, ethyl esterN-(Hydroxymethyl)-N-(methoxymethyl)carbamic acid ethyl esterCarbamic acid, (hydroxymethyl)(methoxymethyl)-, ethyl ester (7CI,8CI,9CI)
Database identifiers
- CAS
13057-81-3- PubChem CID
- 83094
- DTXSID
DTXSID10156628- UNII
- 4VKM3WL4SL
- EC Number
- 235-947-0
- Nikkaji
- J317.787D
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 117
Physicochemical properties
- Boiling point
- 224.8 · 224.8±33.0 °C(Predicted)
- Density
- 1.147 · 1.147±0.06 g/cm3(Predicted)
- pka
- 13.55 · 13.55±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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