ST057192
Basic information
- CAS
189025-09-0- Standard SMILES
CC(CBr)n1ncnn1- InChIKey
AROWRUDDYMCNPY-UHFFFAOYSA-N- Molecular formula
- C4H7BrN4
- Average molar mass
- 191.03 g/mol
- Monoisotopic mass
- 189.98541
Names & identifiers
- Preferred name
- ST057192
- IUPAC
- 2-(1-bromopropan-2-yl)tetrazole
Names & synonyms
189025-09-0ST057192DTXSID00402045RefChem:381420DTXCID503529002-(1-bromopropan-2-yl)-2H-tetrazole2-(2-bromo-1-methylethyl)tetrazoleSTK524073AKOS0054546732-(2-bromo-isopropyl)-1,2,3,4-tetraazole
Database identifiers
- CAS
189025-09-0- PubChem CID
- 4335589
- DTXSID
DTXSID00402045
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 88.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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