 Home > Encyclopedia > TRITYL ISOTHIOCYANATE

TRITYL ISOTHIOCYANATE

TRITYL ISOTHIOCYANATE structure

CAS No:
1726-94-9
Formula:
C20H15NS
Chemical Name:
TRITYL ISOTHIOCYANATE
Synonyms:
TIMTEC-BB SBB008062;TRITYL ISOTHIOCYANATE;TRIPHENYLMETHYL ISOTHIOCYANATE;[Isothiocyanato(diphenyl)methyl]benzene;(isothiocyanatoMethanetriyl)tribenzene
Categories:
Chemical Reagents > Organic Reagents

Request for Quotation

TRITYL ISOTHIOCYANATE Basic Attributes

Molecular Weight：

301.4

Exact Mass：

301.09300

BRN：

2127092

EC Number：

-0

DSSTox ID：

DTXSID70169355

HScode：

2930909090

Characteristics

PSA：

44.4

XLogP3：

5.08130

Density：

1.04±0.1 g/cm3(Predicted)

Melting Point：

136-140 °C(lit.)

Boiling Point：

410.7±14.0 °C(Predicted)

Flash Point：

217ºC

Refractive Index：

1.596

Storage Conditions：

2-8°C

Safety Information

Packing level：

Hazard category：

6.1

Transport codes：

2811

wgk germany：

hazard class code：

20/21/22-36/37/38-42

safety instructions：

26-36/37

Marks：

Precautionary statement(s)：

P261-P280-P305 + P351 + P338-P342 + P311

Hazard Statements：

H302-H312-H315-H319-H332-H334-H335

GHS Classification：

|Danger|H302 (97.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, 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:301.4
XLogP3:7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:301.09252066
Monoisotopic Mass:301.09252066
Topological Polar Surface Area:44.4
Heavy Atom Count:22
Complexity:335
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes