CAS
941716-91-2 Purity
96%
941716-91-2 Purity
96%
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Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate
CAS
941716-96-7
Catalog Number
ACM941716967
Category
Other Products
Molecular Weight
341.2322
Molecular Formula
C16H8F5NO2
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Specification
Synonyms
pentafluorophenyl 1-methyl-1h-indole-7-carboxylate
IUPAC Name
(2,3,4,5,6-pentafluorophenyl) 1-methylindole-7-carboxylate
Canonical SMILES
CN1C=CC2=C1C(=CC=C2)C(=O)OC3=C(C(=C(C(=C3F)F)F)F)F
InChI Key
UEOKRSIJVAQHID-UHFFFAOYSA-N
Boiling Point
481.4ºC at 760 mmHg
Flash Point
244.9ºC
Density
1.46g/cm³
Exact Mass
341.04800
H-Bond Acceptor
7
H-Bond Donor
0
What is the molecular formula of Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate?
The molecular formula is C16H8F5NO2.
When was Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate created in PubChem?
It was created on February 29, 2008.
What is the IUPAC name of Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate?
The IUPAC name is (2,3,4,5,6-pentafluorophenyl) 1-methylindole-7-carboxylate.
What is the InChIKey of Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate?
The InChIKey is UEOKRSIJVAQHID-UHFFFAOYSA-N.
How many hydrogen bond acceptors does Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate have?
It has 7 hydrogen bond acceptors.
What is the exact mass of Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate?
The exact mass is 341.04751931 g/mol.
What is the topological polar surface area of Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate?
The topological polar surface area is 31.2 Ų.
How many defined atom stereocenters does Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate have?
It has 0 defined atom stereocenters.
Is Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate compound canonicalized?
Yes, the compound is canonicalized.
What is the complexity of Pentafluorophenyl 1-methyl-1H-indole-7-carboxylate?
The complexity is 465.
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