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2-CHLOROETHYLISOTHIOCYANATE

2-CHLOROETHYLISOTHIOCYANATE structure

CAS No:
6099-88-3
Formula:
C3H4ClNS
Chemical Name:
2-CHLOROETHYLISOTHIOCYANATE
Synonyms:
2-CHLOROETYL ISOTHIOCYANATE;2-CHLOROETHYL ISOTHIOCYANATE;1-Chloro-2-isothiocyanatoethane;2-Chloroethyl isothiocyanate,98%;Ethane, 1-chloro-2-isothiocyanato-;2-Chloroethyl isothiocyanate, 98% 5GR;Isothiocyanic Acid 2-Chloroethyl Ester
Categories:
Chemical Reagents > Organic Reagents

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Description

clear yellow liquid

2-CHLOROETHYLISOTHIOCYANATE Basic Attributes

Molecular Weight：

121.59

Exact Mass：

120.97500

BRN：

605585

DSSTox ID：

DTXSID20209836

HScode：

29309090

Characteristics

PSA：

44.4

XLogP3：

1.32800

Appearance：

Clear yellow Liquid

Density：

1.265 g/mL at 25 °C(lit.)

Melting Point：

172 °C

Boiling Point：

80 °C13 mm Hg(lit.)

Flash Point：

110 °F

Refractive Index：

n20/D 1.556(lit.)

Storage Conditions：

Flammables area

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 3080 6.1/PG 2

wgk germany：

hazard class code：

10-20/21/22-36/37/38-42

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261-P280-P305 + P351 + P338-P342 + P311

Hazard Statements：

H226-H302-H312-H315-H319-H332-H334-H335

GHS Classification：

|Danger|H226 (90.91%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:121.59
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:120.9752980
Monoisotopic Mass:120.9752980
Topological Polar Surface Area:44.4
Heavy Atom Count:6
Complexity:67.2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-CHLOROETHYL ISOTHIOCYANATE

CAS No.: 6099-88-3

Content: 99.00%

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Guide of 2-CHLOROETHYLISOTHIOCYANATE

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Recommended Suppliers
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2-CHLOROETHYLISOTHIOCYANATE

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