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Home > Encyclopedia > (4-Bromophenyl)methyl thiocyanate

(4-Bromophenyl)methyl thiocyanate

(4-Bromophenyl)methyl thiocyanate structure

(4-Bromophenyl)methyl thiocyanate 

structure
  • CAS No:

    2740-89-8

  • Formula:

    C8H6BrNS

  • Chemical Name:

    (4-Bromophenyl)methyl thiocyanate

  • Synonyms:

    Thiocyanic acid,(4-bromophenyl)methyl ester;Thiocyanic acid,p-bromobenzyl ester;(4-Bromophenyl)methyl thiocyanate;4-Bromobenzyl thiocyanate;1-Bromo-4-(thiocyanatomethyl)benzene

(4-Bromophenyl)methyl thiocyanate Basic Attributes

228.11

228.11

Characteristics

49.1

2.7

1.54

172-175 °C @ Press: 12 Torr

Safety Information

IRRITANT-HARMFUL

Computed Properties

Molecular Weight:228.11
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:226.94043
Monoisotopic Mass:226.94043
Topological Polar Surface Area:49.1
Heavy Atom Count:11
Complexity:155
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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