4-(Methylthio)phenylboronic acid supplier

Name
4-(Methylthio)phenylboronic acid
EINECS
CAS No. 98546-51-1
Article Data17
CAS DataBase
Density 1.22 g/cm³
Solubility
Melting Point 210-214 °C(lit.)
Formula C₇H₉BO₂S
Boiling Point 333.5 °C at 760 mmHg
Molecular Weight 168.024
Flash Point 155.5 °C
Transport Information
Appearance Off-white crystalline powder
Safety 37/39-26-36-7/9
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Methylthiopenylboronic Acid;4-Methylthiophenylboronic acid;4-(Methylthio)benzeneboronic acid;4-(Methylthio)benzene boronic acid;
PSA 65.76000
LogP 0.08830

4-(Methylthio)phenylboronic acid Chemical Properties

IUPAC Name: (4-methylsulfanylphenyl)boronic acid
Empirical Formula: C₇H₉BO₂S
Molecular Weight: 168.0212
Structure of 4-(Methylthio)phenylboronic acid (CAS NO.98546-51-1):

Index of Refraction: 1.583
Molar Refractivity: 45.92 cm³
Molar Volume: 137.3 cm³Polarizability: 18.2×10^-24cm³
Surface Tension: 48.5 dyne/cm
Density: 1.22 g/cm³
Flash Point: 155.5 °C
Enthalpy of Vaporization: 60.83 kJ/mol
Melting Point: 210-214 °C(lit.)
Boiling Point: 333.5 °C at 760 mmHg
Vapour Pressure: 5.41E-05 mmHg at 25°C
Product Categories: Azoles;blocks;BoronicAcids;Boric Acid;Boronic acids;Boronic Acid;Aryl;Organoborons;B (Classes of Boron Compounds)
Physical Appearance: Off-white crystalline powder
Synonyms of 4-(Methylthio)phenylboronic acid (CAS NO.98546-51-1): [4-(Methylsulfanyl)phenyl]boronic acid ; Boronic acid, B-[4-(methylthio)phenyl]- ; [4-(Methylsulfanyl)Phenyl]Boranediol ; 4-Thioanisoleboronic acid
Canonical SMILES: B(C1=CC=C(C=C1)SC)(O)O
InChI: InChI=1S/C7H9BO2S/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5,9-10H,1H3
InChIKey: IVUHTLFKBDDICS-UHFFFAOYSA-N

4-(Methylthio)phenylboronic acid Safety Profile

Hazard Codes: Irritant Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 37/39-26-36-7/9
S37/39:Wear suitable gloves and eye/face protection.
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S7:Keep container tightly closed.
S9:Keep container in a well-ventilated place.
WGK Germany: 3
Hazard Note: Irritant
HazardClass: IRRITANT

Product Name

4-(Methylthio)phenylboronic acid

4-(Methylthio)phenylboronic acid Chemical Properties

4-(Methylthio)phenylboronic acid Safety Profile

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