CAS
99520-57-7 Purity
96%
99520-57-7 Purity
96%
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(S)-1,2,4-Tritosyl butanetriol
CAS
99520-83-9
Catalog Number
ACM99520839
Category
Other Products
Molecular Weight
568.68
Molecular Formula
C25H28O9S3
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Specification
Synonyms
(S)-1,2,4-TRITOSYL BUTANETRIOL;1,2,4-BUTANETRIOL, TRIS(4-METHYLBENZENESULFONATE), (S)
IUPAC Name
[(3S)-3,4-bis-(4-methylphenyl)sulfonyloxybutyl]4-methylbenzenesulfonate
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)OCCC(COS(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C3=CC=C(C=C3)C
InChI Key
FUYYDQSFFYSDLU-QFIPXVFZSA-N
Exact Mass
568.09000
What is the molecular formula of (S)-1,2,4-Tritosyl butanetriol?
The molecular formula of (S)-1,2,4-Tritosyl butanetriol is C25H28O9S3.
What is the synonym for (S)-1,2,4-Tritosyl butanetriol?
The synonym for (S)-1,2,4-Tritosyl butanetriol is (S)-Butane-1,2,4-triyl tris(4-methylbenzenesulfonate).
What is the molecular weight of (S)-1,2,4-Tritosyl butanetriol?
The molecular weight of (S)-1,2,4-Tritosyl butanetriol is 568.7 g/mol.
When was (S)-1,2,4-Tritosyl butanetriol created?
(S)-1,2,4-Tritosyl butanetriol was created on December 10, 2015.
How many hydrogen bond donor counts does (S)-1,2,4-Tritosyl butanetriol have?
(S)-1,2,4-Tritosyl butanetriol has 0 hydrogen bond donor counts.
What is the topological polar surface area of (S)-1,2,4-Tritosyl butanetriol?
The topological polar surface area of (S)-1,2,4-Tritosyl butanetriol is 155 ?2.
How many rotatable bond counts does (S)-1,2,4-Tritosyl butanetriol have?
(S)-1,2,4-Tritosyl butanetriol has 12 rotatable bond counts.
What is the exact mass of (S)-1,2,4-Tritosyl butanetriol?
The exact mass of (S)-1,2,4-Tritosyl butanetriol is 568.08954599 g/mol.
How many defined atom stereocenter counts does (S)-1,2,4-Tritosyl butanetriol have?
(S)-1,2,4-Tritosyl butanetriol has 1 defined atom stereocenter count.
Is (S)-1,2,4-Tritosyl butanetriol canonicalized in PubChem?
Yes, (S)-1,2,4-Tritosyl butanetriol is canonicalized in PubChem.
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