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5-hydroxy-1H-indole-2-carboxylic acid

5-hydroxy-1H-indole-2-carboxylic acid

CAS: 21598-06-1

Formula: C9H7NO3

SMILES: OC(=O)C1=CC2=CC(O)=CC=C2N1

IUPAC: 5-hydroxy-1H-indole-2-carboxylic acid

InChI: InChI=1S/C9H7NO3/c11-6-1-2-7-5(3-6)4-8(10-7)9(12)13/h1-4,10-11H,(H,12,13)

Composition: C (61.02%), H (3.98%), N (7.91%), O (27.09%)

Molar Mass: 177.159

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 177.042593089
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey BIMHWDJKNOMNLD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.26
Topological Polar Surface Area 73.32
Polarizability 18.47
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 21598-06-1 $20.70-$106.95$20.70$37.95$106.95
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98% <7 Days 21598-06-1 $11.39-$143.87$11.39$14.49$37.26$143.87
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95% <5 Days 21598-06-1 $594.00-$739.00$594.00$739.00
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97% <5 Days 21598-06-1 $35.31-$153.84$35.31$41.61$153.84
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