CAS
914348-94-0 Purity
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914348-94-0 Purity
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1-Boc-7-nitro-3-formylindole
CAS
914348-97-3
Catalog Number
ACM914348973
Category
Other Products
Molecular Weight
290.27
Molecular Formula
C14H14N2O5
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Specification
Synonyms
1-Boc-7-nitro-3-formylindole;7-Nitroindole-3-carboxaldehyde, N-boc protected
IUPAC Name
tert-butyl 3-formyl-7-nitroindole-1-carboxylate
Canonical SMILES
CC(C)(C)OC(=O)N1C=C(C2=C1C(=CC=C2)[N+](=O)[O-])C=O
InChI Key
SWKYBDSQTIHFOL-UHFFFAOYSA-N
Boiling Point
454.7ºC at 760 mmHg
Flash Point
228.8ºC
Density
1.31g/cm³
Exact Mass
290.09000
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of 1-Boc-7-nitro-3-formylindole?
The molecular formula of 1-Boc-7-nitro-3-formylindole is C14H14N2O5.
When was 1-Boc-7-nitro-3-formylindole created and last modified?
1-Boc-7-nitro-3-formylindole was created on 2009-05-30 and last modified on 2023-12-30.
What is the IUPAC name of 1-Boc-7-nitro-3-formylindole?
The IUPAC name of 1-Boc-7-nitro-3-formylindole is tert-butyl 3-formyl-7-nitroindole-1-carboxylate.
What is the InChIKey of 1-Boc-7-nitro-3-formylindole?
The InChIKey of 1-Boc-7-nitro-3-formylindole is SWKYBDSQTIHFOL-UHFFFAOYSA-N.
What are the synonyms of 1-Boc-7-nitro-3-formylindole?
Synonyms of 1-Boc-7-nitro-3-formylindole include tert-Butyl 3-formyl-7-nitro-1H-indole-1-carboxylate and 7-NITRO-3-FORMYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER.
What is the molecular weight of 1-Boc-7-nitro-3-formylindole?
The molecular weight of 1-Boc-7-nitro-3-formylindole is 290.27 g/mol.
How many hydrogen bond acceptors does 1-Boc-7-nitro-3-formylindole have?
1-Boc-7-nitro-3-formylindole has 5 hydrogen bond acceptors.
What is the topological polar surface area of 1-Boc-7-nitro-3-formylindole?
The topological polar surface area of 1-Boc-7-nitro-3-formylindole is 94.1 Å2.
Is 1-Boc-7-nitro-3-formylindole a canonical form?
Yes, 1-Boc-7-nitro-3-formylindole is a canonical form.
How many rotatable bonds does 1-Boc-7-nitro-3-formylindole have?
1-Boc-7-nitro-3-formylindole has 3 rotatable bonds.
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