CAS
942413-05-0 Purity
96%
942413-05-0 Purity
96%
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3-Fluoro-1H-indole-2-carboxylic acid
CAS
942433-63-8
Catalog Number
ACM942433638
Category
Other Products
Molecular Weight
179.15
Molecular Formula
C9H6FNO2
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Specification
Synonyms
2-Carboxy-3-fluoro-1H-indole
IUPAC Name
3-fluoro-1H-indole-2-carboxylic acid
Canonical SMILES
C1=CC=C2C(=C1)C(=C(N2)C(=O)O)F
InChI Key
NBRNUWKLKQQDQS-UHFFFAOYSA-N
Exact Mass
179.03800
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of 3-Fluoro-1H-indole-2-carboxylic acid?
The molecular formula of 3-Fluoro-1H-indole-2-carboxylic acid is C9H6FNO2.
What is the molecular weight of 3-Fluoro-1H-indole-2-carboxylic acid?
The molecular weight of 3-Fluoro-1H-indole-2-carboxylic acid is 179.15 g/mol.
What is the IUPAC name of 3-Fluoro-1H-indole-2-carboxylic acid?
The IUPAC name of 3-Fluoro-1H-indole-2-carboxylic acid is 3-fluoro-1H-indole-2-carboxylic acid.
What is the InChI of 3-Fluoro-1H-indole-2-carboxylic acid?
The InChI of 3-Fluoro-1H-indole-2-carboxylic acid is InChI=1S/C9H6FNO2/c10-7-5-3-1-2-4-6(5)11-8(7)9(12)13/h1-4,11H,(H,12,13).
What is the InChIKey of 3-Fluoro-1H-indole-2-carboxylic acid?
The InChIKey of 3-Fluoro-1H-indole-2-carboxylic acid is NBRNUWKLKQQDQS-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Fluoro-1H-indole-2-carboxylic acid?
The canonical SMILES of 3-Fluoro-1H-indole-2-carboxylic acid is C1=CC=C2C(=C1)C(=C(N2)C(=O)O)F.
What is the CAS number of 3-Fluoro-1H-indole-2-carboxylic acid?
The CAS number of 3-Fluoro-1H-indole-2-carboxylic acid is 942433-63-8.
What is the European Community (EC) number of 3-Fluoro-1H-indole-2-carboxylic acid?
The European Community (EC) number of 3-Fluoro-1H-indole-2-carboxylic acid is 695-358-3.
What is the monoisotopic mass of 3-Fluoro-1H-indole-2-carboxylic acid?
The monoisotopic mass of 3-Fluoro-1H-indole-2-carboxylic acid is 179.03825660 g/mol.
Is 3-Fluoro-1H-indole-2-carboxylic acid a canonicalized compound?
Yes, 3-Fluoro-1H-indole-2-carboxylic acid is a canonicalized compound.
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