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2432-77-1

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Basic Information
CAS No.: 2432-77-1
Name: S-Methyl thiohexanoate
Article Data: 4
Molecular Structure:
Molecular Structure of 2432-77-1 (S-Methyl thiohexanoate)
Formula: C7H14 O S
Molecular Weight: 146.254
Synonyms: S-Methylhexanethioate; S-Methyl thiohexanoate
EINECS: 219-410-8
Density: 0.942g/cm3
Boiling Point: 187.2°Cat760mmHg
Flash Point: 60.5°C
PSA: 42.37000
LogP: 2.45630
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Chemistry

Molecular structure of S-Methyl thiohexanoate (CAS NO.2432-77-1) is:

Product Name: S-Methyl thiohexanoate
CAS Registry Number: 2432-77-1
IUPAC Name: S-methyl hexanethioate
Molecular Weight: 146.25046 [g/mol]
Molecular Formula: C7H14OS
XLogP3-AA: 2.6
H-Bond Donor: 0
H-Bond Acceptor: 1
EINECS: 219-410-8
Index of Refraction: 1.46
Molar Refractivity: 42.5 cm3
Molar Volume: 155.1 cm3
Surface Tension: 31 dyne/cm
Density: 0.942 g/cm3
Flash Point: 60.5 °C
Enthalpy of Vaporization: 42.34 kJ/mol
Boiling Point: 187.2 °C at 760 mmHg
Vapour Pressure: 0.638 mmHg at 25 °C
Canonical SMILES: CCCCCC(=O)SC
InChI: InChI=1S/C7H14OS/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3
InChIKey: AKGAHYLJHAOPKQ-UHFFFAOYSA-N

Specification

 S-Methyl thiohexanoate , its cas register number is 2432-77-1. It also can be called Methanethiol caproate ; Hexanethioic acid, S-methyl ester .