【Name】
Boronicacid, B-(2-methylphenyl)-
【Iupac name】
(2-methylphenyl)boronic acid
【CAS Registry number】
16419-60-6
【Synonyms】
Boronicacid, (2-methylphenyl)- (9CI)
o-Tolueneboronic acid (7CI,8CI)
(2-Tolyl)boronic acid
2-Methyl-1-phenylboronic acid
2-Methylbenzeneboronicacid
2-Methylphenylboronic acid
2-Tolueneboronic acid
o-Boronotoluene
o-Methylphenylboronic acid
o-Tolylboronic acid
【Molecular Formula】
C7H9BO2 (Products with the same molecular formula)
【Molecular Weight】
135.96
【Inchi】
InChI=1/C7H9BO2S/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5,9-10H,1H3
【Canonical SMILES】
B(C1=CC=CC=C1C)(O)O
【MOL File】
16419-60-6.mol
Chemical and Physical Properties
【Appearance】
Odorless white - off-white solid
【Density】
1.1g/cm3
【Melting Point】
164-165℃
【Boiling Point】
283.4°Cat760mmHg
【Vapour】
8.13E-05mmHg at 25°C
【Refractive Index】
1.583
【Flash Point】
125.2°C
【Solubilities】
Slightly soluble
【Stability】
Stable at room temperature in closed containers under normal storage and handling conditions.
【Storage temp】
0-6°C
【Computed Properties】
Molecular Weight:135.95616 [g/mol]
Molecular Formula:C7H9BO2
H-Bond Donor:2
H-Bond Acceptor:2
Rotatable Bond Count:1
Exact Mass:136.06956
MonoIsotopic Mass:136.06956
Topological Polar Surface Area:40.5
Heavy Atom Count:10
Formal Charge:0
Complexity:106
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Safety and Handling
【Hazard Codes】
Xi:Irritant
【Risk Statements】
R36/37/38
【Safety Statements 】
S26;S37/39
【HazardClass】
IRRITANT
【Hazard Note】
Irritant
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