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Home > Encyclopedia > Benzene, 1-chloro-2-fluoro-4-isothiocyanato- (9CI)

Benzene, 1-chloro-2-fluoro-4-isothiocyanato- (9CI)

Benzene, 1-chloro-2-fluoro-4-isothiocyanato- (9CI) structure

Benzene, 1-chloro-2-fluoro-4-isothiocyanato- (9CI) 

structure
  • CAS No:

    597545-17-0

  • Formula:

    C7H3ClFNS

  • Chemical Name:

    Benzene, 1-chloro-2-fluoro-4-isothiocyanato- (9CI)

  • Synonyms:

    4-Chloro-3-fluorophenylisothiocyanate;4-chloro-3-fluorophenyl isothiocyanate;1-chloro-2-fluoro-4-isothiocyanatobenzene;BENZENE, 1-CHLORO-2-FLUORO-4-ISOTHIOCYANATO-;SCHEMBL19260919;CTK5B0451;DTXSID20396437;ZINC3885134;4-chloro-3-fluorobenzenisothiocyanate;6430AE

Benzene, 1-chloro-2-fluoro-4-isothiocyanato- (9CI) Basic Attributes

187.6218232

186.966

DTXSID20396437

2930909090

Characteristics

44.4

4.1

Safety Information

|Danger|H302 (100%): 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, P310, P312, P321, P322, P330, P332+P313, P342+P311, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:187.62
XLogP3:4.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:186.9658761
Monoisotopic Mass:186.9658761
Topological Polar Surface Area:44.4
Heavy Atom Count:11
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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