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2386-53-0 | 1-Dodecanesulfonic Acid Sodium Salt
CAS No: 2386-53-0 Catalog No: AG0032R4 MDL No:MFCD00007527
Product Description
Catalog Number:
AG0032R4
Chemical Name:
1-Dodecanesulfonic Acid Sodium Salt
CAS Number:
2386-53-0
Molecular Formula:
C12H25NaO3S
Molecular Weight:
272.3799
MDL Number:
MFCD00007527
IUPAC Name:
sodium;dodecane-1-sulfonate
InChI:
InChI=1S/C12H26O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-16(13,14)15;/h2-12H2,1H3,(H,13,14,15);/q;+1/p-1
InChI Key:
DAJSVUQLFFJUSX-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCS(=O)(=O)[O-].[Na+]
EC Number:
219-200-6
UNII:
4GY1KJW8SI
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.142g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.379g/mol
Monoisotopic Mass:
272.142g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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