Benzenesulfonic acid, dodecyl-, ammonium salt (1:1)

Catalog Number	ACM1331619-2
CAS	1331-61-9
Synonyms	Ammonium dodecylbenzenesulphonate
IUPAC Name	Azanium;2-dodecylbenzenesulfonate
Molecular Weight	343.5
Molecular Formula	C18H33NO3S
Canonical SMILES	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[NH4+]
InChI	InChI=1S/C18H30O3S.H3N/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);1H3
InChI Key	ZLWPAELISNYYGM-UHFFFAOYSA-N
Complexity	346
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Exact Mass	343.21811509
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Monoisotopic Mass	343.21811509
Rotatable Bond Count	11
Topological Polar Surface Area	66.6 Ų

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Benzenesulfonic acid, dodecyl-, ammonium salt (1:1) (1331-61-9)

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