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1-[(1-Methylethyl)thio]propane

1-[(1-Methylethyl)thio]propane structure

CAS No:
5008-73-1
Formula:
C6H14S
Chemical Name:
1-[(1-Methylethyl)thio]propane
Synonyms:
Propane,1-[(1-methylethyl)thio]-;Sulfide,isopropyl propyl;1-[(1-Methylethyl)thio]propane;n-Propyl isopropyl sulfide;Isopropylpropyl sulfide;Propyl isopropyl sulfide;1-(Propan-2-ylsulfanyl)propane

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1-[(1-Methylethyl)thio]propane Basic Attributes

Molecular Weight：

118.24000

Exact Mass：

118.24

EC Number：

225-686-0

UNII：

A3V2T3L7XV

DSSTox ID：

DTXSID10198200

HScode：

2930909090

Characteristics

PSA：

25.30000

XLogP3：

2.53800

Density：

0.833g/cm3

Melting Point：

-96.69°C (estimate)

Boiling Point：

132.1 °C

Flash Point：

23ºC

Refractive Index：

1.445

Safety Information

hazard class code：

R10

safety instructions：

S23-S24/25

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P370+P378, P403+P233, P403+P235, P405, P501

Hazard Statements：

H225

GHS Classification：

|Danger|H225 (97.44%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:118.24
XLogP3:2.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:118.08162162
Monoisotopic Mass:118.08162162
Topological Polar Surface Area:25.3
Heavy Atom Count:7
Complexity:33.2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(1-Methylethyl)thio]propane

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-[(1-Methylethyl)thio]propane

SDS

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