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81430-42-4 | Ethanaminium, N,N-diethyl-N-sulfo-
CAS No: 81430-42-4 Catalog No: AG005KK7 MDL No:
Product Description
Catalog Number:
AG005KK7
Chemical Name:
Ethanaminium, N,N-diethyl-N-sulfo-
CAS Number:
81430-42-4
Molecular Formula:
C6H16NO3S+
Molecular Weight:
182.2611
IUPAC Name:
triethyl(sulfo)azanium
InChI:
InChI=1S/C6H15NO3S/c1-4-7(5-2,6-3)11(8,9)10/h4-6H2,1-3H3/p+1
InChI Key:
AHILOSUFDJRLJY-UHFFFAOYSA-O
SMILES:
CC[N+](S(=O)(=O)O)(CC)CC
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.085g/mol
Formal Charge:
1
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.258g/mol
Monoisotopic Mass:
182.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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