(+/-)-trans-1,2,3,4,4a,9a-Hexahydroanthrone

Base Information

• Chemical Name: (+/-)-trans-1,2,3,4,4a,9a-Hexahydroanthrone
• CAS No.: 85281-07-8
• Molecular Formula: C₁₄H₁₆O
• Molecular Weight: 200.28
• DSSTox Substance ID: DTXSID401190195
• Mol file: 85281-07-8.mol

Synonyms:(+/-)-trans-1,2,3,4,4a,9a-Hexahydroanthrone;DTXSID401190195;85281-07-8;9(2H)-Anthracenone, 1,3,4,4a,9a,10-hexahydro-, (4aS-trans)-

Chemical Property of (+/-)-trans-1,2,3,4,4a,9a-Hexahydroanthrone

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 200.120115130
• Heavy Atom Count: 15
• Complexity: 258

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC2C(C1)CC3=CC=CC=C3C2=O
• Isomeric SMILES: C1CC[C@@H]2[C@@H](C1)CC3=CC=CC=C3C2=O