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3,4-dihydro-2,1-benzoxaborinin-1-ol

3,4-dihydro-2,1-benzoxaborinin-1-ol

CAS: 19206-51-0

Formula: C8H9BO2

SMILES: OB1OCCC2=CC=CC=C12

IUPAC: 3,4-dihydro-1H-2,1-benzoxaborinin-1-ol

InChI: InChI=1S/C8H9BO2/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-4,10H,5-6H2

Composition: C (64.94%), H (6.13%), B (7.31%), O (21.62%)

Molar Mass: 147.97

Atom Count: 20

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 148.06956
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CKEWCFGVNDVQSC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.4
Topological Polar Surface Area 29.46
Polarizability 16.48
Ring Count 2
Rotatable Bond Count 0

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