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CAS No.: | 61197-09-9 |
---|---|
Name: | Propyl 2-methyl-3-furyl disulfide |
Molecular Structure: | |
Formula: | C8H12OS2 |
Molecular Weight: | 188.30 |
Synonyms: | Propyl2-methyl-3-furyl disulfide;Propyl(2-Methyl-3-furyl)disulfide; |
EINECS: | 262-650-3 |
Density: | 1.13 g/cm3 |
Boiling Point: | 231.7 °C at 760 mmHg |
Flash Point: | 94 °C |
PSA: | 63.74000 |
LogP: | 3.73830 |
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Molecular Structure of Furan,2-methyl-3-(propyldithio)- (CAS NO.61197-09-9):
IUPAC Name: 2-Methyl-3-(propyldisulfanyl)furan
Molecular Formula: C8H12OS2
Molecular Weight: 188.30
EINECS: 262-650-3
FEMA: 3607
XLogP3-AA: 2.8
H-Bond Donor: 0
H-Bond Acceptor: 1
Index of Refraction: 1.562
Molar Refractivity: 53.77 cm3
Molar Volume: 165.6 cm3
Surface Tension: 42.1 dyne/cm
Density: 1.13 g/cm3
Flash Point: 94 °C
Enthalpy of Vaporization: 44.94 kJ/mol
Boiling Point: 231.7 °C at 760 mmHg
Vapour Pressure: 0.0931 mmHg at 25 °C
Canonical SMILES: CCCSSC1=C(OC=C1)C
InChI: InChI=1S/C8H12OS2/c1-3-6-10-11-8-4-5-9-7(8)2/h4-5H,3,6H2,1-2H3
InChIKey: YFPPCUTVJGGSQC-UHFFFAOYSA-N
Product Categories: Furan & Benzofuran; API intermediates; sulfide Flavor
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 284mg/kg (284mg/kg) | Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980. |
Safety Information of Furan,2-methyl-3-(propyldithio)- (CAS NO.61197-09-9):
RTECS: JO1975500
Furan,2-methyl-3-(propyldithio)- (CAS NO.61197-09-9), its Synonyms are Propyl 2-methyl-3-furyl disulfide ; 2-Methyl-3-(propyldithio)furan ; 2-Methyl-3-furyl propyl disulfide ; Disulfide, 2-methyl-3-furyl propyl .