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Thiocyanic acid, chloromethyl ester

Thiocyanic acid, chloromethyl ester structure

CAS No:
3268-79-9
Formula:
C2H2ClNS
Chemical Name:
Thiocyanic acid, chloromethyl ester
Synonyms:
Thiocyanic acid,chloromethyl ester;Chloromethyl thiocyanate;(Chloromethyl)thiocyanogen;1-Chloro-1-thiocyanomethane;NSC 96962
Categories:
Inorganic Chemistry > Inorganic Salts

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Description

CLEAR COLOURLESS TO LIGHT YELLOW LIQUID

Thiocyanic acid, chloromethyl ester Basic Attributes

Molecular Weight：

107.56

Exact Mass：

107.56

BRN：

1098487

EC Number：

221-883-0

NSC Number：

96962

DSSTox ID：

DTXSID80186351

HScode：

2930909090

Characteristics

PSA：

49.1

XLogP3：

1.39698

Density：

1.37 g/cm³ @ Temp: 20 °C

Boiling Point：

185 °C

Flash Point：

183 °F

Refractive Index：

n20/D 1.515(lit.)

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 2810 6.1/PG 2

wgk germany：

hazard class code：

20/21/22-32

safety instructions：

13-36/37

RTECS Number：

XK8800000

Marks：

Precautionary statement(s)：

P280

Hazard Statements：

H302 + H312 + H332

GHS Classification：

|Danger|H301 (11.11%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:107.56
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:106.9596479
Monoisotopic Mass:106.9596479
Topological Polar Surface Area:49.1
Heavy Atom Count:5
Complexity:53.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CHLOROMETHYL THIOCYANATE

CAS No.: 3268-79-9

Content: 99.00%

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Guide of Thiocyanic acid, chloromethyl ester

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
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Thiocyanic acid, chloromethyl ester

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