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2,5-DIMETHOXYPHENYLISOTHIOCYANATE

2,5-DIMETHOXYPHENYLISOTHIOCYANATE structure

CAS No:
40532-06-7
Formula:
C9H9NO2S
Chemical Name:
2,5-DIMETHOXYPHENYLISOTHIOCYANATE
Synonyms:
2,5-Dimethoxyphenyl isothiocyanate;2-Isothiocyanato-1,4-dimethoxybenzene;2,5-dimethoxyphenylisothiocyanate;Benzene, 2-isothiocyanato-1,4-dimethoxy-;2-isothiocyanato-1,4-dimethoxy-benzene;2,5-dimethoxybenzenisothiocyanate;ACMC-1AMRR;SCHEMBL1457686;CTK8C6109;DTXSID20193564
Categories:
Chemical Reagents > Organic Reagents

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2,5-DIMETHOXYPHENYLISOTHIOCYANATE Basic Attributes

Molecular Weight：

195.24

Exact Mass：

195.03500

BRN：

3267310

EC Number：

-0

DSSTox ID：

DTXSID20193564

HScode：

29309090

Characteristics

PSA：

62.9

XLogP3：

2.43810

Density：

1.12g/cm3

Melting Point：

33-36 °C(lit.)

Boiling Point：

175 °C10 mm Hg(lit.)

Flash Point：

>230 °F

Refractive Index：

1.537

Safety Information

Packing level：

III

Hazard category：

Transport codes：

2810

wgk germany：

hazard class code：

safety instructions：

26-27-36/37/39-45

Marks：

Precautionary statement(s)：

P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, P501

Hazard Statements：

H314

GHS Classification：

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:195.24
XLogP3:3.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:195.03539970
Monoisotopic Mass:195.03539970
Topological Polar Surface Area:62.9
Heavy Atom Count:13
Complexity:204
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,5-DIMETHOXYPHENYLISOTHIOCYANATE

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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2,5-DIMETHOXYPHENYLISOTHIOCYANATE

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