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(2E)-3-(2,3-dihydro-1H-inden-5-yl)prop-2-enoic acid

(2E)-3-(2,3-dihydro-1H-inden-5-yl)prop-2-enoic acid

CAS: 56635-88-2

Formula: C12H12O2

SMILES: OC(=O)C=CC1=CC=C2CCCC2=C1

IUPAC: (2E)-3-(2,3-dihydro-1H-inden-5-yl)prop-2-enoic acid

InChI: InChI=1S/C12H12O2/c13-12(14)7-5-9-4-6-10-2-1-3-11(10)8-9/h4-8H,1-3H2,(H,13,14)/b7-5+

Composition: C (76.57%), H (6.43%), O (17.00%)

Molar Mass: 188.226

Atom Count: 26

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 188.083729626
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZWQQSSDIRQRRNW-FNORWQNLSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.94
Topological Polar Surface Area 37.3
Polarizability 20.75
Ring Count 2
Rotatable Bond Count 2

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95% <5 Days 56635-88-2 $1,960.00-$3,410.00$1,960.00$2,750.00$3,410.00
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