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1-Nonanesulfonic acid

HCID 189971
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Basic information

CAS
62416-42-6
Standard SMILES
CCCCCCCCCS(=O)(=O)O
InChIKey
ZGAZPDWSRYNUSZ-UHFFFAOYSA-N
Molecular formula
C9H20O3S
Average molar mass
208.32 g/mol
Monoisotopic mass
208.11331567

Names & identifiers

Preferred name
1-Nonanesulfonic acid
IUPAC
nonane-1-sulfonic acid

Names & synonyms

1-NONANESULFONIC ACID62416-42-6DTXSID90276696RefChem:232493DTXCID50227942Nonane-1-sulfonic Acid4PT7C9NP7XSCHEMBL148926SCHEMBL546219SCHEMBL1932857SCHEMBL4273656SCHEMBL4274897
Show more names
SCHEMBL11061814SCHEMBL27588305

Database identifiers

CAS
62416-42-6
PubChem CID
189971
DTXSID
DTXSID90276696
UNII
4PT7C9NP7X
Nikkaji
J520.627H

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
62.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
13
Formal charge
0
Complexity
191

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