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Hexanonacontylbenzene

HCID 165359366
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Basic information

CAS
66326-40-7
Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc1ccccc1
InChIKey
QENMWDIWHKAHBB-UHFFFAOYSA-N
Molecular formula
C102H198
Average molar mass
1,424.7 g/mol
Monoisotopic mass
1,423.54935632

Names & identifiers

Preferred name
Hexanonacontylbenzene
IUPAC
hexanonacontylbenzene

Names & synonyms

HexanonacontylbenzeneDTXSID70131489166326-40-7

Database identifiers

CAS
66326-40-7
PubChem CID
165359366
DTXSID
DTXSID701314891

Properties

Computed structural properties

XLogP
54.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
95
Heavy atoms
102
Formal charge
0
Complexity
1,340

Related reactions

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Compound notes

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