CAS
91340-38-4 Purity
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91340-38-4 Purity
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7-Methylnaphthalene-1-sulfonic acid
CAS
91344-81-9
Catalog Number
ACM91344819
Category
Other Products
Molecular Weight
222.2603
Molecular Formula
C11H10O3S
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Specification
Synonyms
7-Methyl-1-naphthalenesulfonic acid;7-Methylnaphthalene-1-sulfonic acid
IUPAC Name
7-methylnaphthalene-1-sulfonic acid
Canonical SMILES
CC1=CC2=C(C=CC=C2S(=O)(=O)O)C=C1
InChI Key
BXJIZCYGEBTLGO-UHFFFAOYSA-N
Exact Mass
222.03500
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 7-Methylnaphthalene-1-sulfonic acid?
The molecular formula is C11H10O3S.
When was 7-Methylnaphthalene-1-sulfonic acid created in PubChem CID?
It was created on 2007-12-06.
What is the molecular weight of 7-Methylnaphthalene-1-sulfonic acid?
The molecular weight is 222.26 g/mol.
What is the InChI of 7-Methylnaphthalene-1-sulfonic acid?
The InChI is InChI=1S/C11H10O3S/c1-8-5-6-9-3-2-4-11(10(9)7-8)15(12,13)14/h2-7H,1H3,(H,12,13,14).
How many hydrogen bond donor counts does 7-Methylnaphthalene-1-sulfonic acid have?
It has 1 hydrogen bond donor count.
What is the XLogP3-AA value for 7-Methylnaphthalene-1-sulfonic acid?
The XLogP3-AA value is 2.3.
What is the topological polar surface area of 7-Methylnaphthalene-1-sulfonic acid?
The topological polar surface area is 62.8 Ų.
Is 7-Methylnaphthalene-1-sulfonic acid a canonicalized compound in PubChem?
Yes, it is a canonicalized compound.
How many rotatable bond counts does 7-Methylnaphthalene-1-sulfonic acid have?
It has 1 rotatable bond count.
What is the PubChem CID for 7-Methylnaphthalene-1-sulfonic acid?
The PubChem CID is 23550194.
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