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Agn-PC-0nener

HCID 11025933
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
234765-08-3
Standard SMILES
CCCc1cc2c(c(CCC)c1OC)C(=O)c1c(CCC)cc(CCC)c(OC)c1-2
InChIKey
YGYRFKFDKDMJEL-UHFFFAOYSA-N
Molecular formula
C27H36O3
Average molar mass
408.6 g/mol
Monoisotopic mass
408.26644501

Names & identifiers

Preferred name
Agn-PC-0nener
IUPAC
2,5-dimethoxy-1,3,6,8-tetrapropylfluoren-9-one

Names & synonyms

234765-08-3AGN-PC-0NENERDTXSID904523772,5-Dimethoxy-1,3,6,8-tetrapropyl-9H-fluoren-9-one

Database identifiers

CAS
234765-08-3
PubChem CID
11025933
DTXSID
DTXSID90452377

Properties

Computed structural properties

XLogP
8.4
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
10
Heavy atoms
30
Formal charge
0
Complexity
546

Related reactions

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Compound notes

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