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6,7-dimethyl-1H-indole-2-carboxylic acid

6,7-dimethyl-1H-indole-2-carboxylic acid

Formula: C11H11NO2

SMILES: CC1=CC=C2C=C(NC2=C1C)C(O)=O

IUPAC: 6,7-dimethyl-1H-indole-2-carboxylic acid

InChI: InChI=1S/C11H11NO2/c1-6-3-4-8-5-9(11(13)14)12-10(8)7(6)2/h3-5,12H,1-2H3,(H,13,14)

Composition: C (69.83%), H (5.86%), N (7.40%), O (16.91%)

Molar Mass: 189.214

Atom Count: 25

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 189.078978598
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey UYOAURXJFUQILR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.36
Topological Polar Surface Area 53.09
Polarizability 21.39
Ring Count 2
Rotatable Bond Count 1

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <10 Days C11H11NO2 Quote Only