Basic information
- CAS
156731-37-2- Standard SMILES
CC/C=C\CCNC(=O)OC(C)(C)C- InChIKey
QXQIZVKTUCXDIB-SREVYHEPSA-N- Molecular formula
- C11H21NO2
- Average molar mass
- 199.29 g/mol
Names & identifiers
- Preferred name
- tert-butyl N-[(Z)-hex-3-enyl]carbamate
- IUPAC
- tert-butyl N-[(Z)-hex-3-enyl]carbamate
- English name
- Carbamic acid, 3-hexenyl-, 1,1-dimethylethyl ester, (Z)- (9CI)
- Molecular formula
- C11H21NO2
- Molecular weight
- 199.29
Names & synonyms
Carbamic acid, 3-hexenyl-, 1,1-dimethylethyl ester, (Z)- (9CI)
Database identifiers
- CAS
156731-37-2
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 192
Physicochemical properties
- Boiling point
- 277.8 · 277.8±19.0 °C(Predicted)
- Density
- 0.922 · 0.922±0.06 g/cm3(Predicted)
- pka
- 12.77 · 12.77±0.46(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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