1,3,2-Benzoxazaborole, 2-butyl-2,3-dihydro-
Basic information
- CAS
31748-13-7- Standard SMILES
CCCCB1Nc2ccccc2O1- InChIKey
ISCVMVVOSDMEPD-UHFFFAOYSA-N- Molecular formula
- C10H14BNO
- Average molar mass
- 175.04 g/mol
- Monoisotopic mass
- 175.1168442
Names & identifiers
- Preferred name
- 1,3,2-Benzoxazaborole, 2-butyl-2,3-dihydro-
- IUPAC
- 2-butyl-3H-1,3,2-benzoxazaborole
- English name
- 2-Butyl-2,3-dihydro-1,3,2-benzoxazaborole
- Molecular formula
- C10H14BNO
- Molecular weight
- 175.04
Names & synonyms
2-Butyl-2,3-dihydro-1,3,2-benzoxazaborole31748-13-71,3,2-Benzoxazaborole, 2-butyl-2,3-dihydro-o-Aminophenol cyclic butaneboronate2-butyl-3H-1,3,2-benzoxazaboroleDTXSID00341945ISCVMVVOSDMEPD-UHFFFAOYSA-N2-Butyl-2,3-dihydro-1,3,2-benzoxazaborole #
Database identifiers
- CAS
31748-13-7- PubChem CID
- 577228
- DTXSID
DTXSID00341945- Nikkaji
- J102.514G
Properties
Computed structural properties
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 165
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Compound notes
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