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4-Methoxyphenyl isothiocyanate

4-Methoxyphenyl isothiocyanate structure

CAS No:
2284-20-0
Formula:
C8H7NOS
Chemical Name:
4-Methoxyphenyl isothiocyanate
Synonyms:
Benzene,1-isothiocyanato-4-methoxy-;Isothiocyanic acid,p-methoxyphenyl ester;1-Isothiocyanato-4-methoxybenzene;p-Anisyl isothiocyanate;4-Methoxyphenyl isothiocyanate;4-Anisyl isothiocyanate;p-Methoxyphenyl isothiocyanate;4-(Isothiocyanato)anisole;NSC 77713;4-Isothiocyanato-1-methoxybenzene;1-Methoxy-4-isothiocyanatobenzene;2124236-47-9
Categories:
Chemical Reagents > Organic Reagents

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Description

clear yellow liquid after melting

4-Methoxyphenyl isothiocyanate Basic Attributes

Molecular Weight：

165.21

Exact Mass：

165.21

BRN：

606967

EC Number：

218-921-3

NSC Number：

77713

DSSTox ID：

DTXSID00177387

HScode：

29309090

Characteristics

PSA：

53.7

XLogP3：

3.59

Appearance：

clear yellow liquid after melting

Density：

1.1±0.1 g/cm3

Melting Point：

18 °C

Boiling Point：

280.5 °C

Flash Point：

>230 °F

Refractive Index：

1.552

Water Solubility：

It hydrolyzes in water.

Storage Conditions：

Store below +30°C.

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 1760 8/PG 2

wgk germany：

hazard class code：

34-42

safety instructions：

26-27-28-36-45

Marks：

Precautionary statement(s)：

P261-P280-P305 + P351 + P338-P310

Hazard Statements：

H314-H317-H334

GHS Classification：

|Danger|H302 (10.87%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P272, P280, P285, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P304+P341, P305+P351+P338, P310, P312, P321, P330, P333+P313, P342+P311, P363, P405, and P501|Aggregated GHS information provided by 46 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-methoxyphenylisothiocyanate

Computed Properties

Molecular Weight:165.21
XLogP3:3.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:165.02483502
Monoisotopic Mass:165.02483502
Topological Polar Surface Area:53.7
Heavy Atom Count:11
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-Methoxyphenyl isothiocyanate

CAS No.: 2284-20-0

Content: 99.00%

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Guide of 4-Methoxyphenyl isothiocyanate

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
Recommended Suppliers
Latest News
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4-Methoxyphenyl isothiocyanate

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