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2-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE

2-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE structure

2-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE 

structure
  • CAS No:

    57878-93-0

  • Formula:

    C8H6ClNS

  • Chemical Name:

    2-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE

  • Synonyms:

    2-Chloro-1-isothiocyanato-4-methylbenzene;2-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE;2-Chloro-4-methylphenyl isothiocyanate, 95+%;2-Chloro-4-methylphenyl isothiocyanate ,97%;3-Chloro-4-(isothiocyanato)toluene

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

Dark yellow solid

2-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE Basic Attributes

183.66

182.99100

DTXSID70206597

2930909090

Characteristics

44.4

3.38270

1.18g/cm3

138°C/20mm

127.3ºC

1.583

Safety Information

IRRITANT-HARMFUL

R20/21/22;R36/37/38

S26-S36/37/39

Xn:Harmful;

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

H302

Computed Properties

Molecular Weight:183.66
XLogP3:4.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:182.9909481
Monoisotopic Mass:182.9909481
Topological Polar Surface Area:44.4
Heavy Atom Count:11
Complexity:177
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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