CAS
93905-00-1 Purity
96%
93905-00-1 Purity
96%
![4-[2-[4-[2-(Sulfooxy)ethylsulfonyl]-2,5-dimethoxyphenylazo]-3-oxobutyrylamino]-5-methoxy-2-methylbenzenesulfonic acid disodium salt](https://resource.alfa-chemistry.com/structure/93912-54-0.gif)
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Hexadecyl-O-xylenesulfonic acid
CAS
93905-07-8
Catalog Number
ACM93905078
Category
Other Products
Molecular Weight
410.653480 [g/mol]
Molecular Formula
C24H42O3S
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Specification
Synonyms
Hexadecyl-o-xylenesulphonic acid, EINECS 299-842-1, 93905-07-8
IUPAC Name
1-(2-methylphenyl)heptadecane-1-sulfonic acid
Canonical SMILES
CCCCCCCCCCCCCCCCC(C1=CC=CC=C1C)S(=O)(=O)O
InChI Key
FQNJSYWVYFNLQK-UHFFFAOYSA-N
Density
1.004g/cm³
EC Number
299-842-1
Exact Mass
410.28500
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of Hexadecyl-O-xylenesulfonic acid?
The molecular formula of Hexadecyl-O-xylenesulfonic acid is C24H42O3S.
When was Hexadecyl-O-xylenesulfonic acid created in PubChem?
Hexadecyl-O-xylenesulfonic acid was created in PubChem on December 5, 2007.
What is the molecular weight of Hexadecyl-O-xylenesulfonic acid?
The molecular weight of Hexadecyl-O-xylenesulfonic acid is 410.7 g/mol.
What is the IUPAC name of Hexadecyl-O-xylenesulfonic acid?
The IUPAC name of Hexadecyl-O-xylenesulfonic acid is 1-(2-methylphenyl)heptadecane-1-sulfonic acid.
What is the InChIKey of Hexadecyl-O-xylenesulfonic acid?
The InChIKey of Hexadecyl-O-xylenesulfonic acid is FQNJSYWVYFNLQK-UHFFFAOYSA-N.
How many hydrogen bond donor count does Hexadecyl-O-xylenesulfonic acid have?
Hexadecyl-O-xylenesulfonic acid has 1 hydrogen bond donor count.
What is the XLogP3-AA value of Hexadecyl-O-xylenesulfonic acid?
The XLogP3-AA value of Hexadecyl-O-xylenesulfonic acid is 9.3.
How many rotatable bond count does Hexadecyl-O-xylenesulfonic acid have?
Hexadecyl-O-xylenesulfonic acid has 17 rotatable bond count.
What is the topological polar surface area of Hexadecyl-O-xylenesulfonic acid?
The topological polar surface area of Hexadecyl-O-xylenesulfonic acid is 62.8 Ų.
Is Hexadecyl-O-xylenesulfonic acid a canonicalized compound in PubChem?
Yes, Hexadecyl-O-xylenesulfonic acid is a canonicalized compound in PubChem.
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