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1-phenylheptadecan-1-one

1-phenylheptadecan-1-one

CAS: 128189-46-8

Formula: C23H38O

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

IUPAC: 1-phenylheptadecan-1-one

InChI: InChI=1S/C23H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-23(24)22-19-16-15-17-20-22/h15-17,19-20H,2-14,18,21H2,1H3

Composition: C (83.57%), H (11.59%), O (4.84%)

Molar Mass: 330.556

Atom Count: 62

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 330.292265844
Formal Charge 0
FSP3 0.7
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey VUXIOSYYRVXOOT-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 105.5
Topological Polar Surface Area 17.07
Polarizability 41.77
Ring Count 1
Rotatable Bond Count 16

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