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Home > Encyclopedia > 1-Chloro-4-[(1R)-1-isothiocyanatoethyl]benzene

1-Chloro-4-[(1R)-1-isothiocyanatoethyl]benzene

1-Chloro-4-[(1R)-1-isothiocyanatoethyl]benzene structure

1-Chloro-4-[(1R)-1-isothiocyanatoethyl]benzene 

structure
  • CAS No:

    737000-80-5

  • Formula:

    C9H8ClNS

  • Chemical Name:

    1-Chloro-4-[(1R)-1-isothiocyanatoethyl]benzene

  • Synonyms:

    Benzene,1-chloro-4-[(1R)-1-isothiocyanatoethyl]-;1-Chloro-4-[(1R)-1-isothiocyanatoethyl]benzene;1-Chloro-4-[(1R)-1-isothiocyanatoethyl]benzene

1-Chloro-4-[(1R)-1-isothiocyanatoethyl]benzene Basic Attributes

197.68

197.68

DTXSID70426814

Characteristics

1,208 g/cm3

1.5940

Safety Information

III

6.1

2810

20/21/22-36/37/38

26-36/37/39

Computed Properties

Molecular Weight:197.69
XLogP3:4.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:197.0065981
Monoisotopic Mass:197.0065981
Topological Polar Surface Area:44.4
Heavy Atom Count:12
Complexity:181
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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