Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Methyl phenylsulfonylacetate |
EINECS | N/A |
CAS No. | 34097-60-4 | Density | 1.277 g/cm3 |
PSA | 68.82000 | LogP | 1.71410 |
Solubility | Insoluble in water. | Melting Point |
30 °C |
Formula | C9H10O4S | Boiling Point | 445.142 °C at 760 mmHg |
Molecular Weight | 214.242 | Flash Point | 180.623 °C |
Transport Information | N/A | Appearance | white to light yellow solid. |
Safety | 23-24/25 | Risk Codes | 10 |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(Methoxycarbonyl)methyl phenylsulfone;(Phenylsulfonyl)acetic acid methyl ester;Methyl 2-(phenylsulfonyl)acetate; |
Article Data | 30 |
Product Name: Methyl phenylsulfonyl acetate (CAS NO.34097-60-4)
Molecular Formula: C9H10O4S
Molecular Weight: 214.24g/mol
Mol File: 34097-60-4.mol
Melting Point: 30°C
Boiling point: 445.1 °C at 760 mmHg
Flash Point: 180.6 °C
Density: 1.277 g/cm3
Refractive index: n20/D 1.535(lit.)
Surface Tension: 42.8 dyne/cm
Enthalpy of Vaporization: 70.31 kJ/mol
Vapour Pressure: 4.04E-08 mmHg at 25°C
XLogP3-AA: 1.1
H-Bond Donor: 0
H-Bond Acceptor: 4
Structure Descriptors of Methyl phenylsulfonyl acetate (CAS NO.34097-60-4):
IUPAC Name: methyl 2-(benzenesulfonyl)acetate
Canonical SMILES: COC(=O)CS(=O)(=O)C1=CC=CC=C1
InChI: InChI=1S/C9H10O4S/c1-13-9(10)7-14(11,12)8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChIKey: NLEAIFBNKPYTGN-UHFFFAOYSA-N
Product Categories: Benzene series
Safety Information of Methyl phenylsulfonyl acetate (CAS NO.34097-60-4):
Safety Statements: 23-24/25
23: Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer)
24: Avoid contact with skin
25: Avoid contact with eyes
WGK Germany: 3