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3-(2-methylnaphthalen-1-yl)prop-2-enoic acid

3-(2-methylnaphthalen-1-yl)prop-2-enoic acid

CAS: 773130-16-8

Formula: C14H12O2

SMILES: CC1=CC=C2C=CC=CC2=C1C=CC(O)=O

IUPAC: 3-(2-methylnaphthalen-1-yl)prop-2-enoic acid

InChI: InChI=1S/C14H12O2/c1-10-6-7-11-4-2-3-5-13(11)12(10)8-9-14(15)16/h2-9H,1H3,(H,15,16)

Composition: C (79.23%), H (5.70%), O (15.08%)

Molar Mass: 212.248

Atom Count: 28

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 212.083729626
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey WTTYBPPFNYCUFU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.55
Topological Polar Surface Area 37.3
Polarizability 25.43
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 773130-16-8 $2,200.00-$4,136.00$2,200.00$4,136.00
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