4-amino-3-thiocyanatobenzonitrile

Modify Date: 2025-08-23 12:51:36

4-amino-3-thiocyanatobenzonitrile Structure
4-amino-3-thiocyanatobenzonitrile structure
Common Name 4-amino-3-thiocyanatobenzonitrile
CAS Number 68867-21-0 Molecular Weight 175.21000
Density N/A Boiling Point N/A
Molecular Formula C8H5N3S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-Amino-5-cyanophenyl thiocyanate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C8H5N3S
Molecular Weight 175.21000
Exact Mass 175.02000
PSA 98.90000
LogP 2.29486
InChIKey VACLLCFHXXWYQQ-UHFFFAOYSA-N
SMILES N#CSc1cc(C#N)ccc1N

 Synthetic Route

~87%

4-amino-3-thiocyanatobenzonitrile Structure

4-amino-3-thioc...

CAS#:68867-21-0

Literature: Institute of Pharmacology and Toxicology Academy of Military Medical Science, P.L.A Patent: US2011/319423 A1, 2011 ; Location in patent: Page/Page column 9-10 ;

~44%

4-amino-3-thiocyanatobenzonitrile Structure

4-amino-3-thioc...

CAS#:68867-21-0

Literature: Caleta; Grdisa; Mrvos-Sermek; Cetina; Tralic-Kulenovic; Pavelic; Karminski-Zamola Farmaco, 2004 , vol. 59, # 4 p. 297 - 305

 Synonyms

4-Cyan-2-thiocyanato-anilin
4-Amino-3-thiocyanato-benzolsulfonamid
4-Amino-3-rhodanbenzoesaeure
4-amino-3-thiocyanato-benzenesulfonic acid amide
4-cyano-2-thiocyanatoaniline
3-Rhodano-4-amino-benzoesaeure
4-amino-3-thiocyanatobenzenesulfonamide
4-Amino-3-thiocyanato-benzolsulfonsaeure-amid
4-Amino-3-thiocyanato-benzoesaeure
4-amino-3-thiocyano-benzonitrile
4-amino-3-thiocyanato-benzoic acid
6-Amino-3-sulfamoyl-phenylthiocyanat
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