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2-(alpha-Thenoylamino)-2-nitro-5-thiazole

HCID 19646
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3810-35-3
Standard SMILES
O=C(Nc1ncc([N+](=O)[O-])s1)c1cccs1
InChIKey
ZLOXYEZYWCTXHU-UHFFFAOYSA-N
Molecular formula
C8H5N3O3S2
Average molar mass
255.3 g/mol
Monoisotopic mass
254.97723338

Overview

Tenonitrozole is a C-nitro compound and a member of 1,3-thiazoles.

Names & identifiers

Preferred name
2-(alpha-Thenoylamino)-2-nitro-5-thiazole
IUPAC
N-(5-nitro-1,3-thiazol-2-yl)thiophene-2-carboxamide
English name
tenonitrozole
Molecular formula
C8H5N3O3S2
Molecular weight
255.27

Names & synonyms

2-(alpha-Thenoylamino)-2-nitro-5-thiazole2-(alpha-thenoylamino)-5-nitrothiazoleRefChem:187856TENONITROZOLE3810-35-3N-(5-nitro-1,3-thiazol-2-yl)thiophene-2-carboxamideAtricanN-(5-Nitrothiazol-2-yl)thiophene-2-carboxamideTenonitrozolTenonitrozole [INN]N-(5-Nitro-2-thiazolyl)-2-thiophenecarboxamide2-Thiophenecarboxamide, N-(5-nitro-2-thiazolyl)-
Show more names
TC-109Voriconazole Impurity 83
DTXSID5046277PBQ7WLE1WPMFCD00866614alpha-Thenoylamino-2-nitro-5-thiazoleMoniflagonNeo-trichocidTenonitrozole (INN)thenitrazole

Database identifiers

CAS
3810-35-3
PubChem CID
19646
DTXSID
DTXSID5046277
ChEMBL
CHEMBL1082354
ChEBI
CHEBI:135042

Properties

Computed structural properties

XLogP
3
Topological polar surface area
144 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
297

Experimental & physicochemical properties

Solubility37.2 [ug/mL] (The mean of the results at pH 7.4)

Physicochemical properties

Melting point
255 · 255-256°
FDA UNII
7 WLE1WP · PBQ7WLE1WP
ATC code
1 AX08 · P01AX08
Symbol(GHS)
8 · GHS08,GHS06
Signal word
Danger
Hazard statements
312 · H312-H334-H301-H317
Precautionary statements
264 · P264-P270-P301+P310-P321-P330-P405-P501-P261-P285-P304+P341-P342+P311-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P280-P302+P352-P312-P322-P363-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]

P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P316, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P333+P317, P337+P317, P342+P316, P362+P364, P403, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (50%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS08,GHS06
Hazard statements
H312-H334-H301-H317
Precautionary statements
P264-P270-P301+P310-P321-P330-P405-P501-P261-P285-P304+P341-P342+P311-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P280-P302+P352-P312-P322-P363-P501

Chemistry & industry

Pharmacology

ATC CodeP - Antiparasitic products, insecticides and repellents

Upstream & downstream products

Upstream raw materials

2-Amino-5-nitrothiazole2-Thiophenecarbonyl chloridePotassium hydroxide

Suppliers12 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
深圳利斯康医药科技有限公司+86-755-89396905 +86-15013857715 · [email protected]
上海杰股生物科技有限公司021-51698675 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
UNII
PBQ7WLE1WP
EC Number
223-282-9
Nikkaji
J32.517A
+86-88938639 +86-17705817739 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]

Additional notes

DefinitionChEBI: Tenonitrozole is a C-nitro compound and a member of 1,3-thiazoles.