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4-BENZYLOXYPHENYL ISOTHIOCYANATE

4-BENZYLOXYPHENYL ISOTHIOCYANATE structure

CAS No:
139768-71-1
Formula:
C14H11NOS
Chemical Name:
4-BENZYLOXYPHENYL ISOTHIOCYANATE
Synonyms:
4-BENZYLOXYPHENYL ISOTHIOCYANATE;4-BENZYLOXYISOTHIOCYANATE;Benzene, 1-isothiocyanato-4-(phenylmethoxy)- (9CI);4-Benzyloxyphenyl isothiocyanate 98%;1-(benzyloxy)-4-isothiocyanatobenzene

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4-BENZYLOXYPHENYL ISOTHIOCYANATE Basic Attributes

Molecular Weight：

241.31

Exact Mass：

241.05600

BRN：

3298091

DSSTox ID：

DTXSID60370756

HScode：

2930909090

Characteristics

PSA：

53.7

XLogP3：

3.99990

Density：

1.09±0.1 g/cm3(Predicted)

Melting Point：

62 °C

Boiling Point：

392.9±25.0 °C(Predicted)

Flash Point：

191.4ºC

Refractive Index：

1.582

Water Solubility：

Hydrolyzes in water.

Safety Information

Packing level：

III

Hazard category：

hazard class code：

safety instructions：

36/37

Marks：

Hazard note：

Toxic

Precautionary statement(s)：

P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:241.31
XLogP3:5.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:241.05613515
Monoisotopic Mass:241.05613515
Topological Polar Surface Area:53.7
Heavy Atom Count:17
Complexity:261
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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B-D-XYLOPYRANOSYLPHENYL ISOTHIOCYANATE Formula

146194-64-1
BETA-D-GALACTOPYRANOSYLPHENYL ISOTHIOCYANATE Formula

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BETA-D-LACTOPYRANOSYLPHENYL ISOTHIOCYANATE Structure

96324-93-5
CINNAMOYL ISOTHIOCYANATE Structure

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What is 2,4-Dichlorophenyl isothiocyanate

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Guide of 4-BENZYLOXYPHENYL ISOTHIOCYANATE

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

4-BENZYLOXYPHENYL ISOTHIOCYANATE

SDS

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