Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

EC number:
249-655-6
EC name:
Tris(2-hydroxyethyl)methylammonium methyl sulphate
CAS number:
29463-06-7

No inventory information available

Reference substance information

IUPAC name:
1,5-dihydroxy-3-(2-hydroxyethyl)pentan-3-aminium methyl sulfate
Synonyms
Names:
Ethanaminium, 2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (salt)
Identifier:
CAS number
29463-06-7
Identifier:
other: InChl
1S/C7H18NO3.CH4O4S/c1-8(2-5-9,3-6-10)4-7-11;1-5-6(2,3)4/h9-11H,2-7H2,1H3;1H3,(H,2,3,4)/q+1;/p-1
Identifier:
other: SMILES notation
OCC[N+](C)(CCO)CCO.S(=O)(OC)([O-])=O

CAS information

CAS number:
29463-06-7

Molecular and structural information

Molecular formula:
C7H18NO3.CH3O4S
Molecular weight:
275.32
SMILES notation:
COS(=O)(=O)[O-].[NH3+]C(CCO)(CCO)CCO
InChl:
InChI=1/C7H17NO3.CH4O4S/c8-7(1-4-9,2-5-10)3-6-11;1-5-6(2,3)4/h9-11H,1-6,8H2;1H3,(H,2,3,4)
Structural formula:
Chemical structure