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Cas Database |
| Name |
Methyl (methylthio)acetate |
EINECS | 240-683-4 |
| CAS No. | 16630-66-3 | Density | 1.073 g/cm3 |
| PSA | 51.60000 | LogP | 0.52240 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C4H8O2S | Boiling Point | 157.346 °C at 760 mmHg |
| Molecular Weight | 120.172 | Flash Point | 60 °C |
| Transport Information | UN 3272 | Appearance | clear colorless to dark yellow liquid |
| Safety | 24/25 | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols |
 F
|
| Synonyms |
Aceticacid, (methylthio)-, methyl ester (8CI,9CI);(Methylthio)acetic acid methylester;Methyl 2-(methylthio)acetate;Methylsulfanylacetic acid methyl ester; |
Article Data | 13 |
Methyl (methylthio)acetate Chemical Properties
Product Name: Methyl (methylthio)acetate (CAS NO.16630-66-3)
Molecular Formula: C4H8O2S
Molecular Weight: 120.17g/mol
Mol File: 16630-66-3.mol
EINECS: 240-683-4
Boiling point: 49-51 °C12 mm Hg(lit.)
Storage Temperature: 2-8°C
Flash Point: 60 °C
Density: 1.072 g/cm3
Refractive index: n20/D 1.4650(lit.)
Surface Tension: 32.1 dyne/cm
Enthalpy of Vaporization: 39.4 kJ/mol
Vapour Pressure: 2.77 mmHg at 25°C
XLogP3-AA: 0.8
H-Bond Donor: 0
H-Bond Acceptor: 2
Structure Descriptors of Methyl (methylthio)acetate (CAS NO.16630-66-3):
IUPAC Name: methyl 2-methylsulfanylacetate
Canonical SMILES: COC(=O)CSC
InChI: InChI=1S/C4H8O2S/c1-6-4(5)3-7-2/h3H2,1-2H3
InChIKey: HZYCAKGEXXKCDM-UHFFFAOYSA-N
Product Categories: Organics
Methyl (methylthio)acetate Safety Profile
Safety Information of Methyl (methylthio)acetate (CAS NO.16630-66-3):
Hazard Codes: F
Safety Statements: 24/25
24: Avoid contact with skin
25: Avoid contact with eyes
RIDADR: UN 3272 3/PG 3
WGK Germany: 3
F: 8-13
HazardClass: 3.2
PackingGroup: III
Methyl (methylthio)acetate Specification
Methyl (methylthio)acetate , its CAS NO. is 16630-66-3, the synonyms are EINECS 240-683-4 ; Acetic acid, (methylthio)-, methyl ester .
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