CAS
93803-22-6 Purity
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93803-22-6 Purity
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2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium
CAS
93803-26-0
Catalog Number
ACM93803260
Category
Other Products
Molecular Weight
229.296000 [g/mol]
Molecular Formula
C10H15NO3S
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Specification
Synonyms
EINECS 298-296-1, CID10105220, 2,6-Dimethyl-1-(3-sulphonatopropyl)pyridinium, 3-(2,6-dimethylpyridin-1-yl)propane-1-sulfonate, 93803-26-0
IUPAC Name
3-(2,6-dimethylpyridin-1-ium-1-yl)propane-1-sulfonate
Canonical SMILES
CC1=[N+](C(=CC=C1)C)CCCS(=O)(=O)[O-]
InChI Key
SZXKBAYUORLNCA-UHFFFAOYSA-N
EC Number
298-296-1
Exact Mass
229.07700
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium?
The molecular formula of 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium is C10H15NO3S.
When was 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium created in PubChem?
2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium was created in PubChem on October 25, 2006.
What is the molecular weight of 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium?
The molecular weight of 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium is 229.30 g/mol.
What are some synonyms for 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium?
Some synonyms for 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium include EINECS 298-296-1 and 93803-26-0.
What is the InChIKey for 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium?
The InChIKey for 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium is SZXKBAYUORLNCA-UHFFFAOYSA-N.
How many hydrogen bond acceptors does 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium have?
2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium has 3 hydrogen bond acceptors.
What is the XLogP3-AA value for 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium?
The XLogP3-AA value for 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium is 0.9.
How many rotatable bonds does 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium have?
2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium has 3 rotatable bonds.
What is the exact mass of 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium?
The exact mass of 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium is 229.07726451 g/mol.
Is the compound canonicalized in PubChem?
Yes, the compound 2,6-Dimethyl-1-(3-sulfonatopropyl)pyridinium is canonicalized in PubChem.
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