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16630-66-3

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Basic Information
CAS No.: 16630-66-3
Name: METHYL (METHYLTHIO)ACETATE
Article Data: 13
Molecular Structure:
Molecular Structure of 16630-66-3 (METHYL (METHYLTHIO)ACETATE)
Formula: C4H8O2S
Molecular Weight: 120.172
Synonyms: Aceticacid, (methylthio)-, methyl ester (8CI,9CI);(Methylthio)acetic acid methylester;Methyl 2-(methylthio)acetate;Methylsulfanylacetic acid methyl ester;
EINECS: 240-683-4
Density: 1.073 g/cm3
Boiling Point: 157.346 °C at 760 mmHg
Flash Point: 60 °C
Appearance: clear colorless to dark yellow liquid
Hazard Symbols: FlammableF
Safety: 24/25
Transport Information: UN 3272
PSA: 51.60000
LogP: 0.52240
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Chemistry

 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

Safety Profile

 Safety Information of Methyl (methylthio)acetate (CAS NO.16630-66-3):
Hazard Codes: FFlammable 
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

Specification

  Methyl (methylthio)acetate , its CAS NO. is 16630-66-3, the synonyms are EINECS 240-683-4 ;  Acetic acid, (methylthio)-, methyl ester .