Basic information
- CAS
67952-46-9- Standard SMILES
CC(C)OCCOC(N)=O- InChIKey
WFGYALSKIQVJKA-UHFFFAOYSA-N- Molecular formula
- C6H13NO3
- Average molar mass
- 147.17 g/mol
- Monoisotopic mass
- 147.08954328
Names & identifiers
- Preferred name
- Ethanol, 2-(1-methylethoxy)-, 1-carbamate
- IUPAC
- 2-propan-2-yloxyethyl carbamate
- English name
- 2-(1-methylethoxy)ethyl carbamate
- Molecular formula
- C6H13NO3
- Molecular weight
- 147.17
Names & synonyms
2-Isopropoxyethyl carbamate67952-46-9Isopropoxyethyl carbamate(2-Isopropoxyethyl)carbamateEINECS 267-900-5BRN 1757003Ethanol, 2-(1-methylethoxy)-, carbamateEthanol, 2-(1-methylethoxy)-, 1-carbamateDTXSID40887054CARBAMIC ACID, (2-ISOPROPOXYETHYL) ESTER3-03-00-00062 (Beilstein Handbook Reference)RefChem:138263
Show more names
2-Isopropoxyethyl=carbamateCarbamic acid 2-isopropoxyethyl ester
DTXCID5010263692-(1-Methylethoxy)ethyl carbamateSCHEMBL11805700WFGYALSKIQVJKA-UHFFFAOYSA-N2-[(Propan-2-yl)oxy]ethyl carbamateAKOS006337184NS00055530
Database identifiers
- CAS
67952-46-9- PubChem CID
- 50005
- DTXSID
DTXSID40887054- EC Number
- 267-900-5
- Nikkaji
- J67.619E
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 103
Physicochemical properties
- Melting point
- 57 · 57-59 °C
- Boiling point
- 267.28 °C · 267.28°C (rough estimate)
- Density
- 1.2006 · 1.2006 (rough estimate)
- refractive index
- 1.424 · 1.4240 (estimate)
- pka
- 13.31 · 13.31±0.50(Predicted)
- EPA Substance Registry System
- 2 · 2-Isopropoxyethyl carbamate (67952-46-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationEthanol, 2-(1-methylethoxy)-, 1-carbamate: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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