Cularicine

Base Information

• Chemical Name: Cularicine
• CAS No.: 2271-08-1
• Molecular Formula: C18H17NO4
• Molecular Weight: 311.3319
• DSSTox Substance ID: DTXSID40331769
• Nikkaji Number: J2.769.800J
• Wikidata: Q27106272
• Mol file: 2271-08-1.mol

Synonyms:Cularicine;2271-08-1;(13S)-14-methyl-2,6,8-trioxa-14-azapentacyclo[11.7.1.03,11.05,9.017,21]henicosa-1(20),3,5(9),10,17(21),18-hexaen-20-ol;C09398;CHEBI:3955;DTXSID40331769;Q27106272

Chemical Property of Cularicine

Chemical Property:

• Vapor Pressure: 3.29E-09mmHg at 25°C
• Boiling Point: 463.4°C at 760 mmHg
• Flash Point: 234.1°C
• PSA: 51.16000
• Density: 1.37g/cm³
• LogP: 2.93620
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 311.11575802
• Heavy Atom Count: 23
• Complexity: 460

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC2=C3C1CC4=CC5=C(C=C4OC3=C(C=C2)O)OCO5
• Isomeric SMILES: CN1CCC2=C3[C@@H]1CC4=CC5=C(C=C4OC3=C(C=C2)O)OCO5