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Home > Encyclopedia > Benzene, 4-bromo-2-isothiocyanato-1-methoxy- (9CI)

Benzene, 4-bromo-2-isothiocyanato-1-methoxy- (9CI)

Benzene, 4-bromo-2-isothiocyanato-1-methoxy- (9CI) structure

Benzene, 4-bromo-2-isothiocyanato-1-methoxy- (9CI) 

structure
  • CAS No:

    597545-16-9

  • Formula:

    C8H6BrNOS

  • Chemical Name:

    Benzene, 4-bromo-2-isothiocyanato-1-methoxy- (9CI)

  • Synonyms:

    4-bromo-2-isothiocyanato-1-methoxybenzene;4-bromo-2-isothiocyanato-1-methoxy-benzene;SCHEMBL6113969;CTK5B0450;DTXSID50407863;ZINC2727393;AKOS003211285;BENZENE, 4-BROMO-2-ISOTHIOCYANATO-1-METHOXY-

Benzene, 4-bromo-2-isothiocyanato-1-methoxy- (9CI) Basic Attributes

244.10834

242.935

DTXSID50407863

Characteristics

53.7

4

Computed Properties

Molecular Weight:244.11
XLogP3:4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:242.93535
Monoisotopic Mass:242.93535
Topological Polar Surface Area:53.7
Heavy Atom Count:12
Complexity:194
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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