Carbonochloridothioicacid, O-(4-methylphenyl) ester supplier

Name
P-TOLYL CHLOROTHIONOFORMATE
EINECS 213-333-3
CAS No. 937-63-3
Article Data10
CAS DataBase
Density 1.225 g/mL at 25 °C(lit.)
Solubility
Melting Point
Formula C₈H₇ClOS
Boiling Point 244.8 °C at 760 mmHg
Molecular Weight 186.662
Flash Point 101.8 °C
Transport Information UN 3265
Appearance clear yellow liquid
Safety 26-36/37/39-45
Risk Codes 23-34
Molecular Structure
Hazard Symbols T,Xi
Synonyms Formic acid,chlorothio-, O-p-tolyl ester (6CI,7CI,8CI);4-Methylphenyl chlorothioformate;O-4-Methylphenyl chlorothioformate;p-Tolyl chlorothionoformate;p-Tolyloxythiocarbonyl chloride;
PSA 41.32000
LogP 2.89750

Carbonochloridothioicacid, O-(4-methylphenyl) ester Specification

The Carbonochloridothioicacid, O-(4-methylphenyl) ester, with the CAS registry number 937-63-3, is also known as O-p-Tolyl chlorothioformate. It belongs to the product categories of Organic Building Blocks; Sulfur Compounds; Thiocarbonyl Compounds. Its EINECS registry number is 213-333-3. This chemical's molecular formula is C₈H₇ClOS and molecular weight is 186.66. Its IUPAC name is called O-(4-methylphenyl) chloromethanethioate.

Physical properties of Carbonochloridothioicacid, O-(4-methylphenyl) ester: (1)ACD/LogP: 3.72; (2)ACD/LogD (pH 5.5): 3.72; (3)ACD/LogD (pH 7.4): 3.72; (4)ACD/BCF (pH 5.5): 398.66; (5)ACD/BCF (pH 7.4): 398.66; (6)ACD/KOC (pH 5.5): 2529.99; (7)ACD/KOC (pH 7.4): 2529.99; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.598; (11)Molar Refractivity: 49.89 cm³; (12)Molar Volume: 146 cm³; (13)Surface Tension: 49 dyne/cm; (14)Density: 1.277 g/cm³; (15)Flash Point: 101.8 °C; (16)Enthalpy of Vaporization: 46.23 kJ/mol; (17)Boiling Point: 244.8 °C at 760 mmHg; (18)Vapour Pressure: 0.0466 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It may cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC=C(C=C1)OC(=S)Cl
(2)InChI: InChI=1S/C8H7ClOS/c1-6-2-4-7(5-3-6)10-8(9)11/h2-5H,1H3
(3)InChIKey: UNCAXIZUVRKBMN-UHFFFAOYSA-N

Product Name

P-TOLYL CHLOROTHIONOFORMATE

Carbonochloridothioicacid, O-(4-methylphenyl) ester Specification

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