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1-(Ethylthio)octane

1-(Ethylthio)octane structure

CAS No:
3698-94-0
Formula:
C10H22S
Chemical Name:
1-(Ethylthio)octane
Synonyms:
Octane,1-(ethylthio)-;Sulfide,ethyl octyl;1-(Ethylthio)octane;Ethyl octyl sulfide;3-Thiaundecane;Ethyl 1-octyl sulfide

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1-(Ethylthio)octane Basic Attributes

Molecular Weight：

174.35

Exact Mass：

174.35

UNII：

JOZ6D7U0VL

DSSTox ID：

DTXSID4044662

HScode：

2930909090

Characteristics

PSA：

25.3

XLogP3：

4.7

Density：

0.8410

Melting Point：

-53.83°C (estimate)

Boiling Point：

102-103 °C @ Press: 11 Torr

Flash Point：

97.3ºC

Refractive Index：

1.455

Safety Information

Precautionary statement(s)：

P273, P391, P501

Hazard Statements：

H400

GHS Classification：

|Warning|H400 (17.39%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|P273, P391, and P501|Aggregated GHS information provided by 46 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-(Ethylthio)octane Use and Manufacturing

Manufacturing Info：

Octane, 1-(ethylthio)-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:174.35
XLogP3:4.7
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:8
Exact Mass:174.14422188
Monoisotopic Mass:174.14422188
Topological Polar Surface Area:25.3
Heavy Atom Count:11
Complexity:61.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(Ethylthio)octane

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

1-(Ethylthio)octane

SDS

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