Basic information
- Standard SMILES
CC1(C)OC(=O)Nc2ccc(B(O)O)cc21- InChIKey
QHWLPZYUNQBUGQ-UHFFFAOYSA-N- Molecular formula
- C10H12BNO4
- Average molar mass
- 221.02 g/mol
- Monoisotopic mass
- 221.08593826
Names & identifiers
- Preferred name
- (4,4-Dimethyl-2-oxo-1,4-dihydro-2H-3,1-benzoxazin-6-yl)boronic acid
- IUPAC
- (4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)boronic acid
- English name
- Boronic acid, (1,4-dihydro-4,4-dimethyl-2-oxo-2H-3,1-benzoxazin-6-yl)- (9CI)
- Molecular formula
- C10H12BNO4
- Molecular weight
- 221.02
Names & synonyms
304853-90-5(4,4-Dimethyl-2-oxo-2,4-dihydro-1H-benzo[d][1,3]oxazin-6-yl)boronic acid(4,4-Dimethyl-2-oxo-1,4-dihydro-2H-3,1-benzoxazin-6-yl)boronic acid(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)boronic acid(4,4-dimethyl-2-oxo-2,4-dihydro-1H-3,1-benzoxazin-6-yl)boronic acidstarbld0018458SCHEMBL1743997DTXSID20450922QHWLPZYUNQBUGQ-UHFFFAOYSA-N4,4-Dimethyl-2-oxo-2,4-dihydro-1H-benzo [d][1,3]oxazin-6-ylboronic acid4,4-dimethyl-2-oxo-2,4-dihydro-1H-benzo[d][1,3]oxazin-6-ylboronic acid(1, 4-dihydro-4,4-dimethyl-2-oxo-2H-3,1-benzoxazin-6-yl)boronic acid
Show more names
Boronic acid, B-(1,4-dihydro-4,4-dimethyl-2-oxo-2H-3,1-benzoxazin-6-yl)-Boronic acid, (1,4-dihydro-4,4-dimethyl-2-oxo-2H-3,1-benzoxazin-6-yl)- (9CI)
(1,4-dihydro-4,4-dimethyl-2-oxo-2H-3,1 -benzoxazin-6-yl) boronic acid(1,4-dihydro-4,4-dimethyl-2-oxo-2H-3,1 -benzoxazin-6-yl)boronic acid(1,4-dihydro-4,4-dimethyl-2-oxo-2H-3,1-benzooxazin-6-yl)boronic acid(1,4-dihydro-4,4-dimethyl-2-oxo-2H-3,1-benzoxazin-6-yl) boronic acid(1,4-dihydro-4,4-dimethyl-2-oxo-2H-3,1-benzoxazin-6-yl)boronic acid(1,4-dihydro4,4-dimethyl-2-oxo-2H-3,1-benzoxazin-6-yl)boronic acid(1.4-dihydro-4,4-dimethyl-2-oxo-2H-3,1-benzoxazin-6-yl)boronic acid(4,4-dimethyl-1,4-dihydro-2-oxo-2H-3,1 -benzoxazin-6-yl)boronic acid
Database identifiers
- CAS
304853-90-5- PubChem CID
- 10987806
- DTXSID
DTXSID20450922- Nikkaji
- J2.877.074J
Properties
Computed structural properties
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 295
Chemistry & industry
Suppliers2 total
吉林中科研伸科技有限公司18143011203 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
257 records
Linked notes
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