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178442-85-8 | Ethanaminium, N,N,N-trimethyl-2-(2-methyl-1-oxopropoxy)-
CAS No: 178442-85-8 Catalog No: AG00261D MDL No:
Product Description
Catalog Number:
AG00261D
Chemical Name:
Ethanaminium, N,N,N-trimethyl-2-(2-methyl-1-oxopropoxy)-
CAS Number:
178442-85-8
Molecular Formula:
C9H20NO2+
Molecular Weight:
174.2606
IUPAC Name:
trimethyl-[2-(2-methylpropanoyloxy)ethyl]azanium
InChI:
InChI=1S/C9H20NO2/c1-8(2)9(11)12-7-6-10(3,4)5/h8H,6-7H2,1-5H3/q+1
InChI Key:
MDZQLXIAHZOWTP-UHFFFAOYSA-N
SMILES:
O=C(C(C)C)OCC[N+](C)(C)C
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.149g/mol
Formal Charge:
1
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.264g/mol
Monoisotopic Mass:
174.149g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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