Tizoprolic Acid

HCID 65773

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Basic information

CAS: 30709-69-4
Standard SMILES: CCCc1ncc(C(=O)O)s1
InChIKey: IOSZDNOGOPHEPH-UHFFFAOYSA-N
Molecular formula: C7H9NO2S
Average molar mass: 171.22 g/mol
Monoisotopic mass: 171.03539953

Overview

Tizoprolic acid is a small molecule drug. Tizoprolic acid has a monoisotopic molecular weight of 171.04 Da.

Names & identifiers

Preferred name: Tizoprolic Acid
IUPAC: 2-propyl-1,3-thiazole-5-carboxylic acid
English name: Tizoprolic
Molecular formula: C7H9NO2S
Molecular weight: 171.22

Names & synonyms

Tizoprolic acid30709-69-4Acide tizoproliqueAcido tizoprolicoAcidum tizoprolicumDTXSID5057709VGT0G37N5MDTXCID3031498tizoprolique acidRefChem:190190n-propyl-2-thiazolecarboxylic-5-acid2-Propylthiazole-5-carboxylic acid

Show more names

RU 15350Tizoprolic

2-propyl-1,3-thiazole-5-carboxylic acid2-Propyl-5-thiazolecarboxylic acid5-Thiazolecarboxylic acid, 2-propyl-Tizoprolic acid [INN]MFCD008657422-Propyl-5-thiazolcarbonsaeureAcide tizoprolique [INN-French]Acido tizoprolico [INN-Spanish]

Database identifiers

CAS: 30709-69-4
PubChem CID: 65773
DTXSID: DTXSID5057709
ChEMBL: CHEMBL2106500
UNII: VGT0G37N5M
EC Number: 993-689-0
Nikkaji: J20.516H

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 78.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 151

Physicochemical properties

Boiling point: 314.5 · 314.5±15.0 °C(Predicted)
Density: 1.277 · 1.277±0.06 g/cm3(Predicted)
pka: 3.78 · 3.78±0.10(Predicted)
FDA UNII: 0 G37N5M · VGT0G37N5M
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 280 · P280-P305+P351+P338

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.