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1-phenyloctadecan-1-one

1-phenyloctadecan-1-one

CAS: 6786-36-3

Formula: C24H40O

SMILES: CCCCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1

IUPAC: 1-phenyloctadecan-1-one

InChI: InChI=1S/C24H40O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-24(25)23-20-17-16-18-21-23/h16-18,20-21H,2-15,19,22H2,1H3

Composition: C (83.66%), H (11.70%), O (4.64%)

Molar Mass: 344.583

Atom Count: 65

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 344.307915908
Formal Charge 0
FSP3 0.71
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey DBLXXVQTWJFJFI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 110.1
Topological Polar Surface Area 17.07
Polarizability 43.62
Ring Count 1
Rotatable Bond Count 17

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