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6-ethylpyridin-3-ylboronic acid

6-ethylpyridin-3-ylboronic acid

CAS: 1001907-69-2

Formula: C7H10BNO2

SMILES: CCC1=CC=C(C=N1)B(O)O

IUPAC: (6-ethylpyridin-3-yl)boronic acid

InChI: InChI=1S/C7H10BNO2/c1-2-7-4-3-6(5-9-7)8(10)11/h3-5,10-11H,2H2,1H3

Composition: C (55.69%), H (6.68%), B (7.16%), N (9.28%), O (21.19%)

Molar Mass: 150.97

Atom Count: 21

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 151.080459
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey LPXSVMTZVQACFE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.66
Topological Polar Surface Area 53.35
Polarizability 16.24
Ring Count 1
Rotatable Bond Count 2

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