Basic information
- CAS
21441-04-3- Standard SMILES
CN1C(=O)OC(C)(C)c2cc(Br)ccc21- InChIKey
QFXWWJZBORMYDH-UHFFFAOYSA-N- Molecular formula
- C11H12BrNO2
- Average molar mass
- 270.12 g/mol
- Monoisotopic mass
- 269.00514
Names & identifiers
- Preferred name
- 4H-3,1-Benzoxazin-2-one, 1,2-dihydro-6-bromo-1,4,4-trimethyl-
- IUPAC
- 6-bromo-1,4,4-trimethyl-3,1-benzoxazin-2-one
- English name
- 6-Bromo-1,4-dihydro-1,4,4-trimethyl-2H-3,1-benzoxazin-2-one
- Molecular formula
- C11H12BrNO2
- Molecular weight
- 270.12
Names & synonyms
21441-04-3BRN 06520944H-3,1-BENZOXAZIN-2-ONE, 1,2-DIHYDRO-6-BROMO-1,4,4-TRIMETHYL-6-Bromo-1,2-dihydro-1,4,4-trimethyl-4H-3,1-benzoxazin-2-oneDTXSID70175714RefChem:297454DTXCID60982056-Bromo-1,4-dihydro-1,4,4-trimethyl-2H-3,1-benzoxazin-2-one6-Bromo-1,4,4-trimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one6-Bromo-1,4,4-trimethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one2H-3,1-Benzoxazin-2-one, 6-bromo-1,4-dihydro-1,4,4-trimethyl-
Database identifiers
- CAS
21441-04-3- PubChem CID
- 30634
- DTXSID
DTXSID70175714- Nikkaji
- J41.912E
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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