CAS
914348-96-2 Purity
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914348-96-2 Purity
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7-Benzyloxyindole-3-carboxaldehyde,N-boc protected
CAS
914348-99-5
Catalog Number
ACM914348995
Category
Other Products
Molecular Weight
351.4
Molecular Formula
C21H21NO4
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Specification
Synonyms
7-Benzyloxyindole-3-carboxaldehyde, N-boc protected;1-Boc-7-benzyloxy-3-formylindole
IUPAC Name
tert-butyl 3-formyl-7-phenylmethoxyindole-1-carboxylate
Canonical SMILES
CC(C)(C)OC(=O)N1C=C(C2=C1C(=CC=C2)OCC3=CC=CC=C3)C=O
InChI Key
SGLKQGCTNCPIAW-UHFFFAOYSA-N
Boiling Point
511.7ºC at 760 mmHg
Flash Point
263.3ºC
Density
1.14g/cm³
Exact Mass
351.14700
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of 7-Benzyloxyindole-3-carboxaldehyde?
The molecular formula of 7-Benzyloxyindole-3-carboxaldehyde is C21H21NO4.
What is the molecular weight of 7-Benzyloxyindole-3-carboxaldehyde?
The molecular weight of 7-Benzyloxyindole-3-carboxaldehyde is 351.4 g/mol.
When was 7-Benzyloxyindole-3-carboxaldehyde first created in PubChem?
7-Benzyloxyindole-3-carboxaldehyde was first created in PubChem on May 30, 2009.
What is the InChIKey of 7-Benzyloxyindole-3-carboxaldehyde?
The InChIKey of 7-Benzyloxyindole-3-carboxaldehyde is SGLKQGCTNCPIAW-UHFFFAOYSA-N.
What is the Canonical SMILES representation of 7-Benzyloxyindole-3-carboxaldehyde?
The Canonical SMILES representation of 7-Benzyloxyindole-3-carboxaldehyde is CC(C)(C)OC(=O)N1C=C(C2=C1C(=CC=C2)OCC3=CC=CC=C3)C=O.
What is the CAS number of 7-Benzyloxyindole-3-carboxaldehyde?
The CAS number of 7-Benzyloxyindole-3-carboxaldehyde is 914348-99-5.
What is the XLogP3-AA value of 7-Benzyloxyindole-3-carboxaldehyde?
The XLogP3-AA value of 7-Benzyloxyindole-3-carboxaldehyde is 4.2.
How many hydrogen bond acceptors are present in 7-Benzyloxyindole-3-carboxaldehyde?
There are 4 hydrogen bond acceptors present in 7-Benzyloxyindole-3-carboxaldehyde.
What is the topological polar surface area of 7-Benzyloxyindole-3-carboxaldehyde?
The topological polar surface area of 7-Benzyloxyindole-3-carboxaldehyde is 57.5 A^2.
Is the compound 7-Benzyloxyindole-3-carboxaldehyde canonicalized in PubChem?
Yes, the compound 7-Benzyloxyindole-3-carboxaldehyde is canonicalized in PubChem.
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