tris(2-hydroxyethyl)(methyl)azanium hydrate

tris(2-hydroxyethyl)(methyl)azanium hydrate

CAS: 33667-48-0

Formula: C7H20NO4

SMILES: O.C[N+](CCO)(CCO)CCO

IUPAC: tris(2-hydroxyethyl)(methyl)azanium hydrate

InChI: InChI=1S/C7H18NO3.H2O/c1-8(2-5-9,3-6-10)4-7-11;/h9-11H,2-7H2,1H3;1H2/q+1;

Composition: C (46.14%), H (11.06%), N (7.69%), O (35.12%)

Molar Mass: 182.239

Atom Count: 32

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	182.138684548
Formal Charge	1
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	IJGSGCGKAAXRSC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.78
Topological Polar Surface Area	60.69
Polarizability	16.99
Ring Count	0
Rotatable Bond Count	6

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