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2-hydroxy-6-(pentadec-8-en-1-yl)benzoic acid

2-hydroxy-6-(pentadec-8-en-1-yl)benzoic acid

CAS: 22910-60-7

Formula: C22H34O3

SMILES: CCCCCCC=CCCCCCCCC1=C(C(O)=O)C(O)=CC=C1

IUPAC: 2-hydroxy-6-(pentadec-8-en-1-yl)benzoic acid

InChI: InChI=1S/C22H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(23)21(19)22(24)25/h7-8,15,17-18,23H,2-6,9-14,16H2,1H3,(H,24,25)

Composition: C (76.26%), H (9.89%), O (13.85%)

Molar Mass: 346.511

Atom Count: 59

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 346.250794955
Formal Charge 0
FSP3 0.59
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey YXHVCZZLWZYHSA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 105.87
Topological Polar Surface Area 57.53
Polarizability 40.57
Ring Count 1
Rotatable Bond Count 14

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Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 22910-60-7 $142.18-$233.91$142.18$233.91
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