tert-butyl N-(1,2,4-oxadiazol-3-yl)carbamate
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Basic information
- CAS
39512-63-5- Standard SMILES
CC(C)(C)OC(=O)Nc1ncon1- InChIKey
REWQNYFPXZTNHQ-UHFFFAOYSA-N- Molecular formula
- C7H11N3O3
- Average molar mass
- 185.18 g/mol
- Monoisotopic mass
- 185.08004122
Names & identifiers
- Preferred name
- tert-butyl N-(1,2,4-oxadiazol-3-yl)carbamate
- IUPAC
- tert-butyl N-(1,2,4-oxadiazol-3-yl)carbamate
Names & synonyms
39512-63-5tert-butyl N-(1,2,4-oxadiazol-3-yl)carbamateRefChem:895197970-401-1tert-Butyl 1,2,4-oxadiazol-3-ylcarbamateSCHEMBL5834438REWQNYFPXZTNHQ-UHFFFAOYSA-NPBA51263AT38455tert-Butyl1,2,4-oxadiazol-3-ylcarbamate3-t-butyloxycarbonylamino-1,2,4-oxadiazoleEN300-117659
Show more names
TERT-BUTYL (1,2,4-OXADIAZOL-3-YL)CARBAMATE
Database identifiers
- CAS
39512-63-5- PubChem CID
- 22014528
- EC Number
- 970-401-1
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 77.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 190
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Suppliers
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Related reactions
1 records
Compound notes
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