Carbamic acid, methyl-, 1-methylethyl ester
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Basic information
- CAS
10047-90-2- Standard SMILES
CNC(=O)OC(C)C- InChIKey
ZLQUUMARLOVRLO-UHFFFAOYSA-N- Molecular formula
- C5H11NO2
- Average molar mass
- 117.15 g/mol
- Monoisotopic mass
- 117.07897859
Names & identifiers
- Preferred name
- Carbamic acid, methyl-, 1-methylethyl ester
- IUPAC
- propan-2-yl N-methylcarbamate
- English name
- propan-2-yl N-methylcarbamate
- Molecular formula
- C5H11NO2
- Molecular weight
- 117.15
Names & synonyms
10047-90-2Carbamic acid, methyl-, 1-methylethyl ester1-Methylethyl N-methylcarbamateIsopropyl N-methyl carbamatepropan-2-yl N-methylcarbamateNSC-2918334U424V9N2isopropyl methylcarbamateisopropyl N-methylcarbamateNSC 29183Carbamic acid, methyl, isopropyl esterAI3-25332
Show more names
Carbamic acid, N-methyl-, 1-methylethyl ester
Carbamic acid,N-methyl-, 1-methylethyl esterisopropyl-N-methylcarbamatePropan-2-yl methylcarbamateSCHEMBL103480SCHEMBL395102SCHEMBL3171097SCHEMBL11145930SCHEMBL11171403
Database identifiers
- CAS
10047-90-2- PubChem CID
- 82322
- DTXSID
DTXSID20143307- UNII
- 34U424V9N2
- Nikkaji
- J2.610.816K
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 80.5
Physicochemical properties
- Boiling point
- 59 · 59-60 °C(Press: 8 Torr)
- Density
- 0.9744 g/cm3 · 0.9744 g/cm3
- pka
- 13.14 · 13.14±0.46(Predicted)
- FDA UNII
- 34 U424V9N2 · 34U424V9N2
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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