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145349-76-4

Basic Information
CAS No.: 145349-76-4
Name: 4-(Ethylthio)benzeneboronic acid
Article Data: 1
Cas Database
Molecular Structure:
Molecular Structure of 145349-76-4 (4-(Ethylthio)benzeneboronic acid)
Formula: C8H11BO2S
Molecular Weight: 182.051
Synonyms: Boronicacid, [4-(ethylthio)phenyl]- (9CI);4-(Ethylsulfanyl)benzeneboronic acid;4-Ethylsulfanylphenylboronic acid;Boronic acid,B-[4-(ethylthio)phenyl]-;[4-(Ethylthio)phenyl]boronic acid;4-Ethylthiophenylboronic acid;
EINECS: -0
Density: 1.18 g/cm3
Melting Point: 104-106 °C
Boiling Point: 343.5 °C at 760 mmHg
Flash Point: 161.6 °C
Solubility: N/A
Appearance: N/A
Hazard Symbols: IrritantXi, FlammableF
Risk Codes: 36/37/38-37-11
Safety: 26-36-33-29-16-7/9
Transport Information: N/A
PSA: 65.76000
LogP: 0.47840
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    4-(ethylthio)phenylboronic acid

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  • 4-Ethylthiophenylboronic acid

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    4-Ethylthiophenylboronic acid

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    National Research Platform ISO 9001 145349-76-4

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  • 4-(ETHYLTHIO)BENZENEBORONIC ACID

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    4-(ETHYLTHIO)BENZENEBORONIC ACID

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  • 4-(ETHYLTHIO)BENZENEBORONIC ACID

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    4-(ETHYLTHIO)BENZENEBORONIC ACID

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Chemistry

IUPAC Name: (4-ethylsulfanylphenyl)boronic acid 
Empirical Formula: C8H11BO2S
Molecular Weight: 182.0477 
Structure of 4-Ethylthiophenylboronic acid (CAS NO.145349-76-4):

Index of Refraction: 1.571
Molar Refractivity: 50.55 cm3
Molar Volume: 153.7 cm3
Polarizability: 20.04×10-24cm3
Surface Tension: 46.9 dyne/cm
Density: 1.18 g/cm3
Flash Point: 161.6 °C
Enthalpy of Vaporization: 61.99 kJ/mol 
Melting Point: 104-106°C
Boiling Point: 343.5 °C at 760 mmHg
Vapour Pressure: 2.68E-05 mmHg at 25°C 
Product Categories: blocks;BoronicAcids;Boronic acids;Boronic Acid 
Canonical SMILES: B(C1=CC=C(C=C1)SCC)(O)O
InChI: InChI=1S/C8H11BO2S/c1-2-12-8-5-3-7(4-6-8)9(10)11/h3-6,10-11H,2H2,1H3
InChIKey: LMUASBOUSAMURX-UHFFFAOYSA-N

Safety Profile

Hazard Codes: IrritantXi,FlammableF
Risk Statements: 36/37/38-37-11 
R36/37/38:Irritating to eyes, respiratory system and skin. 
R37:Irritating to respiratory system 
R11:Highly flammable.
Safety Statements: 26-36-33-29-16-7/9 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing. 
S33:Take precautionary measures against static discharges. 
S29:Do not empty into drains. 
S16:Keep away from sources of ignition. 
S7:Keep container tightly closed. 
S9:Keep container in a well-ventilated place.
Hazard Note: Irritant

Specification

  4-Ethylthiophenylboronic acid , its cas register number is 145349-76-4. It also can be called [4-(Ethylsulfanyl)phenyl]boronic acid ; Boronic acid, B-[4-(ethylthio)phenyl]- ; 4-(Ethylthio)benzeneboronic acid .