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1-Isothiocyanato-2-methoxyethane

1-Isothiocyanato-2-methoxyethane structure

CAS No:
38663-85-3
Formula:
C4H7NOS
Chemical Name:
1-Isothiocyanato-2-methoxyethane
Synonyms:
Ethane,1-isothiocyanato-2-methoxy-;Isothiocyanic acid,2-methoxyethyl ester;1-Isothiocyanato-2-methoxyethane;2-Methoxyethyl isothiocyanate;1-Isothiocyanato-2-(methyloxy)ethane;2-Isothiocyanatoethyl methyl ether
Categories:
Chemical Reagents > Organic Reagents

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Description

clear colorless to yellow liquid

1-Isothiocyanato-2-methoxyethane Basic Attributes

Molecular Weight：

117.17

Exact Mass：

117.17

BRN：

773990

EC Number：

254-070-4

DSSTox ID：

DTXSID80191965

HScode：

2930909090

Characteristics

PSA：

53.7

XLogP3：

0.73560

Appearance：

clear colorless to yellow liquid

Density：

1.08

Melting Point：

1.080

Boiling Point：

88.5-92 °C @ Press: 23.5 Torr

Flash Point：

66 °C

Refractive Index：

1.511-1.513

Storage Conditions：

Keep Cold

Safety Information

Packing level：

Hazard category：

6.1

Transport codes：

2810

wgk germany：

hazard class code：

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

safety instructions：

39-26-36/37

Marks：

Xi,T,Xn

Hazard note：

Harmful/Irritant

Precautionary statement(s)：

P210-P261-P301 + P310 + P330-P302 + P352 + P312-P304 + P340 + P312-P337 + P313

Hazard Statements：

H225-H301-H312 + H332-H315-H319-H335

GHS Classification：

|Danger|H225 (88.37%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P310, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:117.17
XLogP3:1.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:117.02483502
Monoisotopic Mass:117.02483502
Topological Polar Surface Area:53.7
Heavy Atom Count:7
Complexity:77.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Isothiocyanato-2-methoxyethane

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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1-Isothiocyanato-2-methoxyethane

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