CAS
952664-95-8 Purity
96%
952664-95-8 Purity
96%
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Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate
CAS
952665-00-8
Catalog Number
ACM952665008
Category
Other Products
Molecular Weight
276.287840 [g/mol]
Molecular Formula
C14H16N2O4
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Specification
Synonyms
METHYL 2-TERT-BUTYL-5-NITRO-1H-INDOLE-7-CARBOXYLATE, 952665-00-8, SureCN1466537, CTK5H7613, AG-H-92416, A845264, 2-tert-butyl-5-nitro-1H-indole-7-carboxylic acid methyl ester
IUPAC Name
methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate
Canonical SMILES
CC(C)(C)C1=CC2=CC(=CC(=C2N1)C(=O)OC)[N+](=O)[O-]
InChI Key
CAMMTUHPGSXTMO-UHFFFAOYSA-N
Exact Mass
276.11100
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate?
The molecular formula is C14H16N2O4.
When was Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate created?
It was created on October 30, 2011.
What is the IUPAC name of Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate?
The IUPAC name is methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate.
What is the InChI of Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate?
The InChI is InChI=1S/C14H16N2O4/c1-14(2,3)11-6-8-5-9(16(18)19)7-10(12(8)15-11)13(17)20-4/h5-7,15H,1-4H3.
What is the InChIKey of Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate?
The InChIKey is CAMMTUHPGSXTMO-UHFFFAOYSA-N.
What is the canonical SMILES of Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate?
The canonical SMILES is CC(C)(C)C1=CC2=CC(=CC(=C2N1)C(=O)OC)[N+](=O)[O-].
What is the CAS number of Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate?
The CAS number is 952665-00-8.
What is the molecular weight of Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate?
The molecular weight is 276.29 g/mol.
How many hydrogen bond donor count does Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate have?
It has 1 hydrogen bond donor count.
Is Methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate a canonical compound?
Yes, it is a canonical compound.
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