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2,8-dimethyl-10H-dibenzo[b,e][1,4]oxaborinin-10-ol

CAS No.:
Cat. No.: SC25980
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Product Name :2,8-dimethyl-10H-dibenzo[b,e][1,4]oxaborinin-10-ol
Cat. No.: :SC25980
Purity / Specification :—
CAS No. :1103654-00-7
MDL No. :—
Molecular Formula :C14H13BO2
LogP :—
Molecular Weight :224.07
TPSA :—
Category :Building Blocks
HSN Code :—
SMILES Code :Cc1ccc2c(c1)B(O)c1cc(C)ccc1O2
Melting Point :—
InChI Key : :—
Boiling Point :No data available

Application Note

AI Generated

Generated by AI. Verify before use in regulatory documents.

Lipinski & ADMET Properties

Computational estimate

Lipinski Rule of 5

i
✗ FAIL
MW ≤ 500 Da✓ 224.1 Da
LogP ≤ 5— N/A
HBD ≤ 5— N/A
HBA ≤ 10— N/A

Max 1 violation allowed for oral bioavailability.

Drug-likeness Score

i
57/100

Moderate — typical building block

Predicted LogP

i

N/A

CNS Permeability

i

Clark model · J Pharm Sci, 1999

TPSA data required

Requires experimental confirmation.

⚠ These are computational estimates based on Lipinski & Veber physicochemical rules. They are not validated ADMET predictions and must not be used for clinical, regulatory, or safety decisions. For research use only.