(4-Chlorophenyl)boronic acid

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Names

[ CAS No. ]:
1679-18-1

[ Name ]:
(4-Chlorophenyl)boronic acid

[Synonym ]:
4-Chlorophenylboranic acid
p-chlorophenylboronic aci
para-chlorophenylboronic acid
(4-Chlorophenyl)boronic acid
para-chlorobenzene boronic acid
4-CHLOROPHENYLBORNIC ACID
p-chloro-benzeneboronicaci
MFCD00039137
boronicacid,p-chlorophenyl
4-Chlorophenylboronic acid
EINECS 216-845-5
4-chlorobenzeneboronic acid
4-Chloro phenyl boronic acid
p-chlorophenylboronic acid
p-chlorobenzeneboronic acid
RARECHEM AH PB 0178
Boronic acid, B-(4-chlorophenyl)-

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
295.4±42.0 °C at 760 mmHg

[ Melting Point ]:
284-289 °C(lit.)

[ Molecular Formula ]:
C6H6BClO2

[ Molecular Weight ]:
156.375

[ Flash Point ]:
132.4±27.9 °C

[ Exact Mass ]:
156.014938

[ PSA ]:
40.46000

[ LogP ]:
2.18

[ Vapour Pressure ]:
0.0±0.7 mmHg at 25°C

[ Index of Refraction ]:
1.558

[ Storage condition ]:
Refrigerator (+4°C)

[ Water Solubility ]:
2.5 g/100 mL

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CY8950000
CHEMICAL NAME :
Benzeneboronic acid, p-chloro-
CAS REGISTRY NUMBER :
1679-18-1
BEILSTEIN REFERENCE NO. :
2936346
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H6-B-Cl-O2
MOLECULAR WEIGHT :
156.38
WISWESSER LINE NOTATION :
QBQR DG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00061

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302 + H312 + H332

[ Precautionary Statements ]:
P280

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi:Irritant

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S36-S37/39-S26

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
CY8950000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-CHLOROPHENYL TRIFLUOROMETHANESULFONATE
  • 4-Bromochlorobenzene
  • Triisopropylborate
  • Tripropyl Borate
  • borane
  • Bromo(4-chlorophenyl)magnesium
  • bf3
  • 1,2-bis(p-chlorophenyl)diborane(6)
  • Water

DownStream

  • 4-(4-CHLOROPHENOXY)BENZALDEHYDE
  • 2-Butanone,4-(4-chlorophenyl)-
  • 1-(4-CHLORO-PHENYL)-ETHANONEOXIME
  • 4,4'-Dichlorobenzophenone
  • 2,4,4',6-tetrachlorobiphenyl
  • 4-(Trifluoromethylthio)chlorobenzene
  • Fenofibrate
  • 5-(4-chlorophenyl)-2-furaldehyde
  • 5-(4-Chlorophenyl)-2-thiophenecarbaldehyde
  • 4'-Chloro-4-biphenylcarboxylic acid

Articles

Cationic Pd(II)-catalyzed highly enantioselective arylative cyclization of alkyne-tethered enals or enones initiated by carbopalladation of alkynes with arylboronic acids.

Org. Lett. 7th ed., 14 , 1756-1759, (2012)

Cationic Pd(II)-catalyzed enantioselective arylative cyclization of alkyne-tethered enals or enones initiated by carbopalladation of alkynes was developed without the necessity of a redox system.

Ruthenium(0)-catalyzed sp3 C-H bond arylation of benzylic amines using arylboronates.

Org. Lett. 7th ed., 14 , 1930-1933, (2012)

A Ru-catalyzed direct arylation of benzylic sp(3) carbons of acyclic amines with arylboronates is reported. This highly regioselective and efficient transformation can be performed with various combin...

Tandem-type Pd(II)-catalyzed oxidative Heck reaction/intramolecular C-H amidation sequence: a novel route to 4-aryl-2-quinolinones.

Chem. Commun. (Camb.) 36th ed., 48 , 4332-4334, (2012)

A novel catalytic method for synthesizing 4-aryl-2-quinolinones is reported. The process involves two mechanistically independent, sequential Pd(II)-catalyzed reactions--the oxidative Heck reaction an...


More Articles

Related Compounds

  • (4-chlorophenyl)boronic acid
  • (4-Chlorophenyl)boronic acid
  • bis(4-chlorophenyl)boronic acid 4-(hydroxymethyl)imidazole ester
  • (3-Amino-4-chlorophenyl)boronic acid
  • (3-Amino-4-chlorophenyl)boronic acid hydrochloride
  • (3-Butoxy-4-chlorophenyl)boronic acid
  • 4-[(2-Cyclopropyl-2-methylpropyl)carbamoyl]-3-methylbutanoic acid
  • 4-(1-Benzofuran-4-yl)-3-bromobenzamide
  • 1-Methyl-4-(3-methylpiperidin-1-yl)cyclohexane-1-carboxylic acid
  • 1-Methyl-4-[4-(propan-2-yl)piperazin-1-yl]cyclohexane-1-carboxylic acid
  • 4-amino-1-(4-methylpent-3-en-1-yl)-1H-pyrazole-3-carboxamide
  • 2-(3-{4-[2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}propyl)-2,3-dihydro-1H-isoindole-1,3-dione
  • rac-3-{[(1R,5R,6S)-6-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)bicyclo[3.2.0]heptan-3-yl]formamido}pentanoic acid
  • 1-{1-[(tert-butoxy)carbonyl]azetidin-3-yl}-4-formyl-1H-pyrazole-3-carboxylic acid
  • 4-formyl-1-(thian-3-yl)-1H-pyrazole-3-carboxylic acid
  • 1-(azetidin-3-yl)-4-formyl-1H-pyrazole-3-carboxylic acid
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