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2,4-dimethyl-2,3-dihydro-1-benzofuran-5-carboxylic acid

2,4-dimethyl-2,3-dihydro-1-benzofuran-5-carboxylic acid

Formula: C11H12O3

SMILES: CC1CC2=C(O1)C=CC(C(O)=O)=C2C

IUPAC: 2,4-dimethyl-2,3-dihydro-1-benzofuran-5-carboxylic acid

InChI: InChI=1/C11H12O3/c1-6-5-9-7(2)8(11(12)13)3-4-10(9)14-6/h3-4,6H,5H2,1-2H3,(H,12,13)

Composition: C (68.74%), H (6.29%), O (24.97%)

Molar Mass: 192.214

Atom Count: 26

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 192.078644246
Formal Charge 0
FSP3 0.36
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey BBZIMTDQSYOIJL-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.55
Topological Polar Surface Area 46.53
Polarizability 19.83
Ring Count 2
Rotatable Bond Count 1

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98% <10 Days C11H12O3 Quote Only
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