Choline tosylate

Catalog Number	ACM55357385
CAS	55357-38-5
Structure
Synonyms	2-Hydroxy-N,N,N-trimethyl-ethanaminium 4-methylbenzenesulfonic acid salt
IUPAC Name	2-Hydroxyethyl(trimethyl)azanium;4-methylbenzenesulfonate
Molecular Weight	275.37
Molecular Formula	C12H21NO4S
Canonical SMILES	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](C)(C)CCO
InChI	InChI=1S/C7H8O3S.C5H14NO/c1-6-2-4-7(5-3-6)11(8,9)10;1-6(2,3)4-5-7/h2-5H,1H3,(H,8,9,10);7H,4-5H2,1-3H3/q;+1/p-1
InChI Key	DVGVMQVOCJNXNJ-UHFFFAOYSA-M
Melting Point	95 °C
Purity	95%+
Complexity	240
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Exact Mass	275.11912932
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Monoisotopic Mass	275.11912932
Rotatable Bond Count	2
Topological Polar Surface Area	85.8 Ų

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Choline tosylate (55357-38-5)

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