4-Iodobenzenecarbohydrazide

HCID 306104

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Grundinformationen

CAS: 39115-95-2
Standard-SMILES: NNC(=O)c1ccc(I)cc1
InChIKey: ZVFGHUJYTXEOSI-UHFFFAOYSA-N
Summenformel: C7H7IN2O
Durchschnittliche Molmasse: 262,05 g/mol
Monoisotopische Masse: 261,96031

Namen und Bezeichner

Bevorzugter Name: 4-Iodobenzenecarbohydrazide
IUPAC: 4-iodobenzohydrazide
Englischer Name: 4-Iodobenzhydrazide
Summenformel: C7H7IN2O
Molmasse: 262.05

Namen und Synonyme

4-iodobenzenecarbohydrazideRefChem:524241674-177-34-iodobenzohydrazide4-Iodobenzhydrazide39115-95-2MFCD002701074-iodobenzoylhydrazine4 Iodo benzohydrazideNSC2034304-Iodobenzoic acid hydrazide4-iodo-benzoic acid hydrazide

Weitere Namen anzeigen

ASISCHEM D13390Benzoic acid, 4-iodo-, hydrazide

4-Iodobenzoi4-iodanylbenzohydrazide4-Jod-benzoyl-hydrazin4-Iodo Benzoyl Hydrazine4-Iodobenzoic acid, hydrazideSCHEMBL1363640CHEMBL3091864DTXSID10308403

Datenbank-Bezeichner

CAS: 39115-95-2
PubChem CID: 306104
DTXSID: DTXSID10308403
ChEMBL: CHEMBL3091864
EC Number: 674-177-3
Nikkaji: J1.560.320H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,6
Polarare Oberfläche (TPSA): 55,1 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 11
Formalladung: 0
Komplexität: 143

Physikochemische Eigenschaften

Schmelzpunkt: 173 °C · 173 °C
Dichte: 1.884 · 1.884±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)
pka: 12.13 · 12.13±0.10(Predicted)

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.