Basic information
- CAS
2193059-07-1- Standard SMILES
CC(C)(C)OC(=O)NCC1CC(=O)C1(C)C- InChIKey
UTNBCASXGPLGIR-UHFFFAOYSA-N- Molecular formula
- C12H21NO3
- Average molar mass
- 227.3 g/mol
- Monoisotopic mass
- 227.15214353
Names & identifiers
- Preferred name
- Tert-butyl n-[(2,2-dimethyl-3-oxocyclobutyl)methyl]carbamate
- IUPAC
- tert-butyl N-[(2,2-dimethyl-3-oxocyclobutyl)methyl]carbamate
Names & synonyms
2193059-07-1tert-butyl n-[(2,2-dimethyl-3-oxocyclobutyl)methyl]carbamatetert-Butyl ((2,2-dimethyl-3-oxocyclobutyl)methyl)carbamatestarbld0034528TMD05907EN300-1700843
Database identifiers
- CAS
2193059-07-1- PubChem CID
- 137952051
- EC Number
- 172-797-4
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 302
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…