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Home > Encyclopedia > 1-Bromo-4-fluoro-2-isothiocyanatobenzene

1-Bromo-4-fluoro-2-isothiocyanatobenzene

1-Bromo-4-fluoro-2-isothiocyanatobenzene structure

1-Bromo-4-fluoro-2-isothiocyanatobenzene 

structure
  • CAS No:

    175205-35-3

  • Formula:

    C7H3BrFNS

  • Chemical Name:

    1-Bromo-4-fluoro-2-isothiocyanatobenzene

  • Synonyms:

    Benzene,1-bromo-4-fluoro-2-isothiocyanato-;1-Bromo-4-fluoro-2-isothiocyanatobenzene;2-Bromo-5-fluorophenyl isothiocyanate

  • Categories:

    Food Additives  >  Odorants

1-Bromo-4-fluoro-2-isothiocyanatobenzene Basic Attributes

232.07

232.07

DTXSID40395780

Characteristics

44.4

3.32250

1.59g/cm3

287.9ºC at 760mmHg

127.9ºC

1.604

Safety Information

III

6.1

2923

20/21/22

36

T

Toxic/Stench

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

H302

Computed Properties

Molecular Weight:232.07
XLogP3:4.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:230.91536
Monoisotopic Mass:230.91536
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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