3-ethylphenylboronic acid

3-ethylphenylboronic acid

CAS: 90555-65-0

Formula: C8H11BO2

SMILES: CCC1=CC=CC(=C1)B(O)O

IUPAC: (3-ethylphenyl)boronic acid

InChI: InChI=1S/C8H11BO2/c1-2-7-4-3-5-8(6-7)9(10)11/h3-6,10-11H,2H2,1H3

Composition: C (64.07%), H (7.39%), B (7.21%), O (21.33%)

Molar Mass: 149.98

Atom Count: 22

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	150.08521
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	JIMVRUCDZGFJRE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.25
Topological Polar Surface Area	40.46
Polarizability	17.14
Ring Count	1
Rotatable Bond Count	2

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AA BLOCKS INC

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