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4-(naphthalen-2-yl)butanoic acid

4-(naphthalen-2-yl)butanoic acid

CAS: 782-28-5

Formula: C14H14O2

SMILES: OC(=O)CCCC1=CC2=CC=CC=C2C=C1

IUPAC: 4-(naphthalen-2-yl)butanoic acid

InChI: InChI=1S/C14H14O2/c15-14(16)7-3-4-11-8-9-12-5-1-2-6-13(12)10-11/h1-2,5-6,8-10H,3-4,7H2,(H,15,16)

Composition: C (78.48%), H (6.59%), O (14.93%)

Molar Mass: 214.264

Atom Count: 30

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 214.099379691
Formal Charge 0
FSP3 0.21
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HBRVUQIGDLSBCB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.02
Topological Polar Surface Area 37.3
Polarizability 25.75
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 782-28-5 $51.35-$359.43$51.35$63.37$86.31$225.06$359.43
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97% <5 Days 782-28-5 $274.90$274.90
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