4-ethoxy-2,5-dimethylphenylboronic acid

4-ethoxy-2,5-dimethylphenylboronic acid

CAS: 1217500-56-5

Formula: C10H15BO3

SMILES: CCOC1=CC(C)=C(C=C1C)B(O)O

IUPAC: (4-ethoxy-2,5-dimethylphenyl)boronic acid

InChI: InChI=1S/C10H15BO3/c1-4-14-10-6-7(2)9(11(12)13)5-8(10)3/h5-6,12-13H,4H2,1-3H3

Composition: C (61.90%), H (7.79%), B (5.57%), O (24.74%)

Molar Mass: 194.04

Atom Count: 29

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	194.111424
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	LCSUJJZAQIIJTR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.9
Topological Polar Surface Area	49.69
Polarizability	21.42
Ring Count	1
Rotatable Bond Count	3

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