CAS
99859-97-7 Purity
96%
99859-97-7 Purity
96%
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5-Iodonaphthalene-2-carboxylic acid
CAS
99866-71-4
Catalog Number
ACM99866714
Category
Other Products
Molecular Weight
298.07655
Molecular Formula
C11H7IO2
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Specification
Synonyms
5-Iodonaphthalene-2-carboxylic acid
IUPAC Name
5-iodonaphthalene-2-carboxylic acid
Canonical SMILES
C1=CC2=C(C=CC(=C2)C(=O)O)C(=C1)I
InChI Key
SVRZGKPAJVVTIG-UHFFFAOYSA-N
Exact Mass
297.94900
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 5-Iodonaphthalene-2-carboxylic acid according to the reference?
The molecular formula of 5-Iodonaphthalene-2-carboxylic acid is C11H7IO2.
When was 5-Iodonaphthalene-2-carboxylic acid created and modified according to the reference?
It was created on 2007-02-09 and modified on 2023-12-30.
What is the IUPAC name of 5-Iodonaphthalene-2-carboxylic acid according to the reference?
The IUPAC name is 5-iodonaphthalene-2-carboxylic acid.
What is the InChIKey of 5-Iodonaphthalene-2-carboxylic acid according to the reference?
The InChIKey is SVRZGKPAJVVTIG-UHFFFAOYSA-N.
What is the Canonical SMILES of 5-Iodonaphthalene-2-carboxylic acid according to the reference?
The Canonical SMILES is C1=CC2=C(C=CC(=C2)C(=O)O)C(=C1)I.
What is the XLogP3-AA value of 5-Iodonaphthalene-2-carboxylic acid according to the reference?
The XLogP3-AA value is 3.3.
How many hydrogen bond donor counts does 5-Iodonaphthalene-2-carboxylic acid have according to the reference?
It has 1 hydrogen bond donor count.
What is the heavy atom count of 5-Iodonaphthalene-2-carboxylic acid according to the reference?
The heavy atom count is 14.
Is the compound canonicalized according to the reference?
Yes, the compound is canonicalized.
What is the topological polar surface area of 5-Iodonaphthalene-2-carboxylic acid according to the reference?
The topological polar surface area is 37.3 Å^2.
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