Zurück
HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 34024Erstellt: 27. Oktober 2026

cis-4-Cyclohexen-1,2-dicarboximid

TETRAHYDROTHALIMIDE · Phthalimide, tetrahydro · cis-1,2,3,6-Tetrahydrophthalimide · CIS-1,2,3,6-tetrahudrophthalimide · cis-4-Cyclohexene-1,2-dicarboximide · 4,5,6,7-Tetrahydroisoindole-1,3-dione · 1H-Isoindole-1,3(2H)-dione, tetrahydro- · CIS-1,2,3,6-TETRAHYDROPHTHALIMIDE, 5GM, NEAT

https://huagongshe.com/de/chemical/34024

Molekülstruktur von cis-4-Cyclohexen-1,2-dicarboximid

Identifikatoren & physikalische Daten

CAS No.27813-21-4
SummenformelC8H9NO2
Durchschnittliche Molmasse151,16 g/mol
Monoisotopische Masse151,06332853 g/mol
SMILESO=C1NC(=O)C2=C1CCCC2
InChIKeyAFJWMGOTLUUGHF-UHFFFAOYSA-N
PubChem CID34024
EC No.225-211-7
DTXSIDDTXSID90963771
Lokaler Namecis-4-Cyclohexen-1,2-dicarboximid

Chemische & physikalische Eigenschaften

XLogP0,7
Polarare Oberfläche (TPSA)46,2
H-Brücken-Donoren1
H-Brücken-Akzeptoren2
Frei drehbare Bindungen0
Schwere Atome11
Formalladung0
Komplexität239
PestizidePesticide (Tetrahydrophthalimide (THPI)) -> USDA PDBPesticide degradation product
Schmelzpunkt129-133 °C(lit.)
Siedepunkt273.17°C (rough estimate)
Dichte1.2023 (rough estimate)
Brechungsindex1.5810 (estimate)
InChIInChI=1/C8H9NO2/c10-7-5-3-1-2-4-6(5)8(11)9-7/h1-2,5-6H,3-4H2,(H,9,10,11)/t5-,6+
InChIKeyCIFFBTOJCKSRJY-OLQVQODUNA-N
SMILESC1(NC(=O)[C@@]2([H])CC=CC[C@@]12[H])=O |&1:4,10,r|
CAS Datenbank27813-21-4(CAS DataBase Reference)
EPA chemische InformationenTetrahydrophthalimide (27813-21-4)

Sicherheit & Vorschriften

GHS-EinstufungThis chemical does not meet GHS hazard criteria for 25% (1 of 4) of reports.WarningH302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Regulatorische InformationenREACH registered substance: 3,4,5,6-tetrahydrophthalimide (EC: 225-211-7)
Hazard Classes and CategoriesAcute Tox. 4 (75%)
USGS Health-Based Screening Levels for Evaluating Water-QualityTetrahydrophthalimidePesticide degradation productSmith, C.D. and Nowell, L.H., 2024. Health-Based Screening Levels for evaluating water-quality data (3rd ed.). DOI:10.5066/F71C1TWP
Wassergefährdungsklasse (WGK)3
RTECS-Nr.GW4635000