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2-METHOXY-5-METHYLPHENYL ISOTHIOCYANATE

2-METHOXY-5-METHYLPHENYL ISOTHIOCYANATE structure

2-METHOXY-5-METHYLPHENYL ISOTHIOCYANATE 

structure
  • CAS No:

    190774-56-2

  • Formula:

    C9H9NOS

  • Chemical Name:

    2-METHOXY-5-METHYLPHENYL ISOTHIOCYANATE

  • Synonyms:

    2-METHOXY-5-METHYLPHENYL ISOTHIOCYANATE;2-Isothiocyanato-1-methoxy-4-methylbenzene;Benzene, 2-isothiocyanato-1-methoxy-4-methyl- (9CI);2-Methoxy-5-methylphenyl isothiocyanate,97%;2-Methoxy-5-Methylphenyl isothiocyanate, 97% 5GR

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

clear yellow liquid

2-METHOXY-5-METHYLPHENYL ISOTHIOCYANATE Basic Attributes

179.24

179.04000

6919550

DTXSID40345068

29309090

Characteristics

53.7

2.73790

Clear yellow Liquid

1.146 g/mL at 25 °C(lit.)

288ºC(lit.)

288 °C(lit.)

>230 °F

n 20/D 1.632(lit.)

0.00125mmHg at 25°C

Safety Information

II

6.1

2810

3

34

26-27-36/37/39-45

C

P280-P305 + P351 + P338-P310

H314

|Danger|H302 (11.63%): 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, P363, 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:179.24
XLogP3:3.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:179.04048508
Monoisotopic Mass:179.04048508
Topological Polar Surface Area:53.7
Heavy Atom Count:12
Complexity:189
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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