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(4-CHLOROBENZYL)THIO]ACETICACID

(4-CHLOROBENZYL)THIO]ACETICACID structure

(4-CHLOROBENZYL)THIO]ACETICACID 

structure
  • CAS No:

    90649-82-4

  • Formula:

    C9H9ClO2S

  • Chemical Name:

    (4-CHLOROBENZYL)THIO]ACETICACID

  • Synonyms:

    NSC65091;STK288044;MLS000061925;SMR000070786;SDCCGMLS-0045680.P002;2-(4-Chlorobenzylthio)acetic acid;2-[(4-chlorophenyl)methylthio]acetic acid;2-[(4-chlorophenyl)methylsulfanyl]ethanoic acid

(4-CHLOROBENZYL)THIO]ACETICACID Basic Attributes

216.68500

216.00100

65091

DTXSID80289891

2930909090

Characteristics

62.60000

2.65780

1.36g/cm3

356.2ºC at 760mmHg

169.2ºC

Computed Properties

Molecular Weight:216.68
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:216.0011784
Monoisotopic Mass:216.0011784
Topological Polar Surface Area:62.6
Heavy Atom Count:13
Complexity:167
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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