Chemical identity

2-Nitro-4-thiocyanato Aniline

CAS 54029-45-7 · C7H5N3O2S

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-02071
PubChem CID104677
Name2-Nitro-4-thiocyanato Aniline
CAS RN54029-45-7
Molecular formulaC7H5N3O2S
Molecular weight195.2 g/mol
IUPAC name2-Nitro-4-thiocyanatobenzenamine
InChIKeyQUWHIBBGKKRYFW-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 104677
Two-dimensional chemical structure of 2-Nitro-4-thiocyanato Aniline, CAS 54029-45-7
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 1 ring, includes aromatic atoms, includes aliphatic carbon, contains a nitro substructure. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres0
Ring count1
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESC1=CC(=C(C=C1SC#N)[N+](=O)[O-])N
InChINot listed
Formula from structureC7H5N3O2S
Molecular weight from structure195.2 g/mol

03India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNO EXACT MATCH FOUNDCAS 54029-45-7 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 54029-45-7 has no exact match in the reviewed SCOMET list.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

04Names and relationships

Associated parent compound

Albendazole

View API and impurity family

Other names

  • 2-Nitro-4-thiocyanato Aniline/Albendazole Impurity 5
  • 2-Nitro-4-thiocyanato Aniline
  • Albendazole Impurity 5
  • 4-Amino-3-nitrophenyl thiocyanate
  • 54029-45-7
  • P5R584ZAAL
  • RefChem:1070263
  • 258-931-5
  • 2-Nitro-4-thiocyanoaniline
  • 4-thiocyano-2-nitroaniline
  • MFCD00463878
  • Thiocyanic acid, 4-amino-3-nitrophenyl ester

Related records from the same parent family

05Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

06Sources