CID 3081854

Base Information

• Chemical Name: CID 3081854
• CAS No.: 140835-18-3
• Molecular Formula: C25H38T2O3
• Molecular Weight: 392.5995
• DSSTox Substance ID: DTXSID701101448
• Wikipedia: HU-243
• Pharos Ligand ID: DXA1L4KLKS2K
• Mol file: 140835-18-3.mol

Synonyms:(3H)HU 243;3-dimethylheptyl-11-hydroxyhexahydrocannabinol;HU 243;HU-243;HU243

Chemical Property of CID 3081854

Chemical Property:

• Vapor Pressure: 1.02E-09mmHg at 25°C
• Boiling Point: 472.2 °C at 760 mmHg
• Flash Point: 239.4 °C
• PSA: 49.69000
• LogP: 6.30340
• XLogP3: 7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 392.31419363
• Heavy Atom Count: 28
• Complexity: 500

Purity/Quality:

99%, ^*data from raw suppliers

[6AR-(6AA,8B,9A,10AB)]-3-(1,1-DIMETHYLHEPTYL)-6A,7,8,9,10,10A-HEXAHYDRO-9-T-1-HYDROXY-6,6-DIMETHYL-6H-DIBENZO[B,D]PYRAN-8-T-9-METHANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(C)(C)C1=CC(=C2C3CC(CCC3C(OC2=C1)(C)C)CO)O
• Isomeric SMILES: [H][C@@]1(C[C@@H]2[C@@H](C[C@]1([3H])CO)C3=C(C=C(C=C3OC2(C)C)C(C)(C)CCCCCC)O)[3H]