ChemicalBook--->CAS DataBase List--->625-80-9

625-80-9

625-80-9 Structure

625-80-9 Structure
IdentificationMore
[Name]

2,2'-Thiobispropane
[CAS]

625-80-9
[Synonyms]

2,4-DIMETHYL-3-THIAPENTANE
DIISOPROPYL SULFIDE
DIISOPROPYL SULPHIDE
ISOPROPYL SULFIDE
ISOPROPYL SULPHIDE
(i-C3H7)2S
2-(Isopropylsulfanyl)propane
2,2’-thiobis-propan
2,2’-thiobis-Propane
2,2'-Thiobispropane
methylethyl
Propane, 2,2'-thiobis-
propane,2,2’-thiobis-
Diisopropylsulfide,99%
2-Propan-2-ylsulfanylpropane
[EINECS(EC#)]

210-911-7
[Molecular Formula]

C6H14S
[MDL Number]

MFCD00008895
[Molecular Weight]

118.24
[MOL File]

625-80-9.mol
Chemical PropertiesBack Directory
[Appearance]

liquid with a penetrating and very unpleasant odour
[Melting point ]

-102.7°C
[Boiling point ]

120 °C763 mm Hg(lit.)
[density ]

0.814 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.4379(lit.)
[Fp ]

45 °F
[storage temp. ]

Flammables area
[form ]

liquid
[color ]

Colorless to Almost colorless
[Specific Gravity]

0.814
[Odor]

at 0.10 % in propylene glycol. sulfury vegetable garlic
[Stability:]

Stable. Highly flammable. Incompatible with strong oxidizing agents, strong bases, strong reducing agents.
[Odor Type]

sulfurous
[Water Solubility ]

Not miscible or difficult to mix with water.
[Specific Heat Capacity]

Cp(liquid):232J/(g·K),at 25℃
[BRN ]

1731257
[Henry's Law Constant]

2.8×10-3 mol/(m3Pa) at 25℃, Brockbank (2013)
[Dielectric constant]

5.8099999999999996
[InChI]

1S/C6H14S/c1-5(2)7-6(3)4/h5-6H,1-4H3
[InChIKey]

XYWDPYKBIRQXQS-UHFFFAOYSA-N
[SMILES]

CC(C)SC(C)C
[LogP]

2.840
[CAS DataBase Reference]

625-80-9(CAS DataBase Reference)
[NIST Chemistry Reference]

Diisopropyl sulfide(625-80-9)
[EPA Substance Registry System]

625-80-9(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
[Signal word ]

Danger
[Hazard statements ]

H225-H315-H319-H335
[Precautionary statements ]

P210-P302+P352-P305+P351+P338
[Hazard Codes ]

F,Xi
[Risk Statements ]

R11:Highly Flammable.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

UN 1993 3/PG 2
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

2930.90.9250
[HazardClass ]

3
[PackingGroup ]

II
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Eye Irrit. 2
Flam. Liq. 2
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2,2'-Thiobispropane(625-80-9).msds
Hazard InformationBack Directory
[Chemical Properties]

liquid with a penetrating and very unpleasant odour
[Uses]

Used as a flavoring agents and intermediate for organic synthesis.
[Definition]

ChEBI: Diisopropyl sulfide is an aliphatic sulfide.
[Synthesis Reference(s)]

Synthesis, p. 58, 1979 DOI: 10.1055/s-1979-28556
Spectrum DetailBack Directory
[Spectrum Detail]

2,2'-Thiobispropane(625-80-9)MS
2,2'-Thiobispropane(625-80-9)1HNMR
2,2'-Thiobispropane(625-80-9)13CNMR
2,2'-Thiobispropane(625-80-9)IR1
2,2'-Thiobispropane(625-80-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Isopropyl sulfide, 99%(625-80-9)
[Alfa Aesar]

Diisopropyl sulfide, 99%(625-80-9)
[Sigma Aldrich]

625-80-9(sigmaaldrich)
[TCI AMERICA]

Isopropyl Sulfide,>98.0%(GC)(625-80-9)
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