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Name	Methylthiomethyl butyrate	EINECS	277-989-2
CAS No.	74758-93-3	Density	1.022 g/cm³
PSA	51.60000	LogP	1.65020
Solubility	N/A	Melting Point	N/A
Formula	C₆H₁₂O₂S	Boiling Point	182.3 ºC at 760 mmHg
Molecular Weight	148.22	Flash Point	68.6 ºC
Transport Information	N/A	Appearance	colorless to pale yellow clear liquid
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Methylthiomethylbutyrate;Methylthio Methyl butyrate;

Methylthiomethyl butyrate Chemical Properties

Molecular Structure of Butanoic acid,(methylthio)methyl ester (CAS NO.74758-93-3):

IUPAC Name: Methylsulfanylmethyl butanoate
Molecular Formula: C₆H₁₂O₂S
Molecular Weight: 148.22
EINECS: 277-989-2
FEMA: 3879
XLogP3-AA: 1.7
H-Bond Donor: 0
H-Bond Acceptor: 2
Index of Refraction: 1.458
Molar Refractivity: 39.61 cm³
Molar Volume: 145 cm³
Surface Tension: 32.4 dyne/cm
Density: 1.022 g/cm³
Flash Point: 68.6 °C
Enthalpy of Vaporization: 41.85 kJ/mol
Boiling Point: 182.3 °C at 760 mmHg
Vapour Pressure: 0.818 mmHg at 25 °C
Appearance: colorless to pale yellow clear liquid
Product Categories: aldehyde Flavor; thioester Flavor
Canonical SMILES: CCCC(=O)OCSC
InChI: InChI=1S/C6H12O2S/c1-3-4-6(7)8-5-9-2/h3-5H2,1-2H3
InChIKey: PGAUNUCMBMQPFT-UHFFFAOYSA-N

Methylthiomethyl butyrate Specification

Butanoic acid,(methylthio)methyl ester (CAS NO.74758-93-3), its Synonyms are Methyl 2-methylthiobutyrate ; Methylthiomethyl butyrate ; (Methylthio)methyl butyrate .

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