CAS 25487-66-5|3-Carboxyphenylboronic acid

Introduction：Basic information about CAS 25487-66-5|3-Carboxyphenylboronic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. 3-Carboxyphenylboronic acid BiologicalActivity
3. Chemical & Physical Properties
4. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
5. Safety Information
6. Customs
7. Articles3
8. Synonyms

Common Name	3-Carboxyphenylboronic acid
CAS Number	25487-66-5	Molecular Weight	165.94
Density	1.4±0.1 g/cm3	Boiling Point	434.5±47.0 °C at 760 mmHg
Molecular Formula	C₇H₇BO₄	Melting Point	243-247 °C(lit.)
MSDS	ChineseUSA	Flash Point	216.6±29.3 °C

Names

Name	3-boronobenzoic acid
Synonym	More Synonyms

3-Carboxyphenylboronic acid BiologicalActivity

Description	3-Carboxyphenylboronic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related Catalog	Research Areas >>OthersSignaling Pathways >>Others >>Others

Chemical & Physical Properties

Density	1.4±0.1 g/cm3
Boiling Point	434.5±47.0 °C at 760 mmHg
Melting Point	243-247 °C(lit.)
Molecular Formula	C₇H₇BO₄
Molecular Weight	165.94
Flash Point	216.6±29.3 °C
Exact Mass	166.043747
PSA	77.76000
LogP	1.27
Vapour Pressure	0.0±1.1 mmHg at 25°C
Index of Refraction	1.585
InChIKey	DBVFWZMQJQMJCB-UHFFFAOYSA-N
SMILES	O=C(O)c1cccc(B(O)O)c1
Storage condition	0-6°C
Water Solubility	2.5 g/100 mL

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CY8750000

CHEMICAL NAME :: Benzeneboronic acid, m-carboxy-

CAS REGISTRY NUMBER :: 25487-66-5

BEILSTEIN REFERENCE NO. :: 2967400

LAST UPDATED :: 199712

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C7-H7-B-O4

MOLECULAR WEIGHT :: 165.95

WISWESSER LINE NOTATION :: VHOR CBQQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >3 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: APYPAY Acta Physiologica Polonica. (Karger-Libri, POB CH-4009, Warszawa, Switzerland) V.1-41, 1950-90. Volume(issue)/page/year: 12,173,1961

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 2560 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: 14KTAK "Boron, Metallo-Boron Compounds and Boranes," Adams, R.M., ed., New York, John Wiley & Sons, Inc., 1964 Volume(issue)/page/year: -,693,1964

Safety Information

Hazard Codes	Xi:Irritant
Risk Phrases	R36/37/38
Safety Phrases	S37/39-S26
RIDADR	NONH for all modes of transport
WGK Germany	2
RTECS	CY8750000
HS Code	2931900090

Customs

HS Code	2931900090
Summary	2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%

Articles3

Heterocycles 60 , 1891-1897, (2003)

Novel rhodamine dyes via Suzuki coupling of xanthone triflates with arylboroxins Calitree, B. D.; Detty, M. R.

Synlett , 89-92, (2010)

Selective urokinase-type plasminogen activator (uPA) inhibitors. Part 3: 1-isoquinolinylguanidines.

Bioorg. Med. Chem. Lett. 14 , 3227-3230, (2004)

A series of 1-isoquinolinylguanidines are shown to be potent inhibitors of uPA with selectivity over tPA and plasmin. Potency is enhanced by the presence of a 4-halo and a 7-aryl substituent, particul...

Synonyms

3-(dihydroxyborane)benzoic acid

meta-carboxyphenylboronic acid

m-Carboxyphenylboronic acid

m-Carboxybenzeneboronic acid

3-Carboxybenzeneboronic Acid

3-(Dihydroxyboryl)benzoic acid

3-Carboxyphenylboronic acid

3-Carboxy-phenylboronic acid

Benzeneboronic acid, m-carboxy-

3-(dihydroxyboranyl)benzoic acid

MFCD00036833

Benzoic acid, 3-borono-

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