4-Chloro-3-methyl-1H-pyrazole-5-carboxylic acid

HCID 17688981

Grundinformationen

CAS
29400-84-8
Standard-SMILES
Cc1[nH]nc(C(=O)O)c1Cl
InChIKey
FWSYEYQXPSSQMV-UHFFFAOYSA-N
Summenformel
C5H5ClN2O2
Durchschnittliche Molmasse
160,56 g/mol
Monoisotopische Masse
160,0039551

Namen und Bezeichner

Bevorzugter Name
4-Chloro-3-methyl-1H-pyrazole-5-carboxylic acid
IUPAC
4-chloro-5-methyl-1H-pyrazole-3-carboxylic acid
Englischer Name
4-chloro-3-methyl-1H-pyrazole-5-carboxylic acid(SALTDATA: FREE)
Summenformel
C5H5ClN2O2
Molmasse
160.56

Namen und Synonyme

29400-84-84-Chloro-3-methyl-1H-pyrazole-5-carboxylic acidRefChem:521337801-868-04-chloro-5-methyl-1H-pyrazole-3-carboxylic acidMFCD16556153CHEMBL3930621H-pyrazole-3-carboxylic acid, 4-chloro-5-methyl-SCHEMBL948870SCHEMBL14879418FWSYEYQXPSSQMV-UHFFFAOYSA-NALBB-027971
Weitere Namen anzeigen
MFCD160444424-chloro-3-methyl-1H-pyrazole-5-carboxylic acid(SALTDATA: FREE)
BBL013035BDBM50220851SBB082382STL163888AKOS005141763AKOS005716261RS-0355SY335636

Datenbank-Bezeichner

CAS
29400-84-8
PubChem CID
17688981
ChEMBL
CHEMBL393062
EC Number
801-868-0

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,1
Polarare Oberfläche (TPSA)
66 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
1
Schwere Atome
10

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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)

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.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)

Sicherheitsdaten

Alarmwort
Warnung
Gefahrenhinweise
Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302

Chemie und Industrie

Anbieter16 Anbieter

宁波振岳医药科技有限公司19817745290 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
上海健超生物科技有限公司15021035486 18081542813 · [email protected]
上海景容化学科技有限公司021-60546673 13701861782 · [email protected]

Zugehörige Reaktionen

2

Notizen zur Verbindung

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