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2-butyldecanoic acid

2-butyldecanoic acid

CAS: 52304-09-3

Formula: C14H28O2

SMILES: CCCCCCCCC(CCCC)C(O)=O

IUPAC: 2-butyldecanoic acid

InChI: InChI=1/C14H28O2/c1-3-5-7-8-9-10-12-13(14(15)16)11-6-4-2/h13H,3-12H2,1-2H3,(H,15,16)

Composition: C (73.63%), H (12.36%), O (14.01%)

Molar Mass: 228.376

Atom Count: 44

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 228.208930142
Formal Charge 0
FSP3 0.93
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey AVZVXSXEVJTJAB-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 67.86
Topological Polar Surface Area 37.3
Polarizability 27.03
Ring Count 0
Rotatable Bond Count 11

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