CAS
952649-12-6 Purity
96%
952649-12-6 Purity
96%
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6-tert-Butoxy-2-tert-butyl-5-nitro-1H-indole
CAS
952664-74-3
Catalog Number
ACM952664743
Category
Other Products
Molecular Weight
290.357480 [g/mol]
Molecular Formula
C16H22N2O3
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Specification
Synonyms
6-TERT-BUTOXY-2-TERT-BUTYL-5-NITRO-1H-INDOLE, 952664-74-3, SureCN1465664, CTK5H7607, AG-H-92409, A845258, 2-tert-butyl-6-[(2-methylpropan-2-yl)oxy]-5-nitro-1H-indole
IUPAC Name
2-tert-butyl-6-[(2-methylpropan-2-yl)oxy]-5-nitro-1H-indole
Canonical SMILES
CC(C)(C)C1=CC2=CC(=C(C=C2N1)OC(C)(C)C)[N+](=O)[O-]
InChI Key
SVERKZLQFAYTSY-UHFFFAOYSA-N
Exact Mass
290.16300
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 6-tert-Butoxy-2-tert-butyl-5-nitro-1H-indole?
The molecular formula is C16H22N2O3.
When was this compound first created and modified?
It was created on October 30, 2011, and last modified on December 30, 2023.
What is the IUPAC name of this compound?
The IUPAC name is 2-tert-butyl-6-[(2-methylpropan-2-yl)oxy]-5-nitro-1H-indole.
What is the InChIKey of this compound?
The InChIKey is SVERKZLQFAYTSY-UHFFFAOYSA-N.
What is the molecular weight of this compound?
The molecular weight is 290.36 g/mol.
How many hydrogen bond donor counts does this compound have?
It has 1 hydrogen bond donor count.
What is the exact mass of this compound?
The exact mass is 290.16304257 g/mol.
How many rotatable bond counts does this compound have?
It has 3 rotatable bond counts.
Does this compound have any defined atom stereocenter counts?
No, it does not have any defined atom stereocenter counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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