4-(2-Nitrophenyl)thiazole-2-amine

HCID 595779

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Basic information

CAS: 90323-06-1
Standard SMILES: Nc1nc(-c2ccccc2[N+](=O)[O-])cs1
InChIKey: JJERKMNYIBNFTE-UHFFFAOYSA-N
Molecular formula: C9H7N3O2S
Average molar mass: 221.24 g/mol
Monoisotopic mass: 221.02589746

Names & identifiers

Preferred name: 4-(2-Nitrophenyl)thiazole-2-amine
IUPAC: 4-(2-nitrophenyl)-1,3-thiazol-2-amine
English name: 4-(2-Nitro-phenyl)-thiazol-2-ylamine
Molecular formula: C9H7N3O2S
Molecular weight: 221.24

Names & synonyms

90323-06-14-(2-Nitrophenyl)thiazole-2-amine4-(2-Nitrophenyl)thiazol-2-amine4-(2-Nitrophenyl)-1,3-thiazol-2-amine4-(2-Nitro-phenyl)-thiazol-2-ylamineMFCD023523184-(2-nitrophenyl)-1,3-thiazole-2-amine4-(2-nitrophenyl)-2-thiazolamine_x000D_4-(2-Nitrophenyl)thiazole-2-amine4-(O-Nitrophenyl)-2-thiazolamine4-(2-nitrophenyl)Oprea1_011495

Show more names

SCHEMBL220611SCHEMBL3026474DTXSID603442952-Thiazolamine, 4-(2-nitrophenyl)-AKOS009266857FN155678MS-11009SY004980

Database identifiers

CAS: 90323-06-1
PubChem CID: 595779
DTXSID: DTXSID60344295
EC Number: 675-475-6
Nikkaji: J1.397.400D

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 113 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 246

Physicochemical properties

Density: 1.459 · 1.459
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 501 · P501-P260-P264-P280-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P405

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word: Danger
Symbol(GHS): GHS05
Hazard statements: H314
Precautionary statements: P501-P260-P264-P280-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P405