tert-butyl N-(carbamimidoyl(cyclohexyl)methyl)carbamate
Basic information
- CAS
1341344-97-5- Standard SMILES
CC(C)(C)OC(=O)NC(C(=N)N)C1CCCCC1- InChIKey
DDQJHTSVSYQYRH-UHFFFAOYSA-N- Molecular formula
- C13H25N3O2
- Average molar mass
- 255.36 g/mol
- Monoisotopic mass
- 255.19467705
Names & identifiers
- Preferred name
- tert-butyl N-(carbamimidoyl(cyclohexyl)methyl)carbamate
- IUPAC
- tert-butyl N-(2-amino-1-cyclohexyl-2-iminoethyl)carbamate
Names & synonyms
1341344-97-5tert-butyl N-[carbamimidoyl(cyclohexyl)methyl]carbamatetert-butyl N-(carbamimidoyl(cyclohexyl)methyl)carbamateRefChem:896357843-180-3tert-Butyl (2-amino-1-cyclohexyl-2-iminoethyl)carbamatetert-butyl N-(2-amino-1-cyclohexyl-2-iminoethyl)carbamatestarbld0020829AKOS013728842CS-0247464EN300-366510Z1227722605
Show more names
tert-butyl N-(2-amino-1-cyclohexyl-2-imino-ethyl)carbamate
Database identifiers
- CAS
1341344-97-5- PubChem CID
- 64405992
- EC Number
- 843-180-3
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 304
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
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