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131418-60-5 | 1-Decanaminium, N-[2-(2-butoxyethoxy)ethyl]-N,N-dimethyl-, chloride (1:1)
CAS No: 131418-60-5 Catalog No: AG000W52 MDL No:
Product Description
Catalog Number:
AG000W52
Chemical Name:
1-Decanaminium, N-[2-(2-butoxyethoxy)ethyl]-N,N-dimethyl-, chloride (1:1)
CAS Number:
131418-60-5
Molecular Formula:
C20H44ClNO2
Molecular Weight:
366.0219
IUPAC Name:
2-(2-butoxyethoxy)ethyl-decyl-dimethylazanium;chloride
InChI:
InChI=1S/C20H44NO2.ClH/c1-5-7-9-10-11-12-13-14-15-21(3,4)16-18-23-20-19-22-17-8-6-2;/h5-20H2,1-4H3;1H/q+1;/p-1
InChI Key:
VXVUBRHZECXEQZ-UHFFFAOYSA-M
SMILES:
CCCCCCCCCC[N+](CCOCCOCCCC)(C)C.[Cl-]
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.306g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.027g/mol
Monoisotopic Mass:
365.306g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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