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70862-65-6 | 1H-Imidazolium,1,3-didecyl-2-methyl-, chloride (1:1)
CAS No: 70862-65-6 Catalog No: AG0063AS MDL No:
Product Description
Catalog Number:
AG0063AS
Chemical Name:
1H-Imidazolium,1,3-didecyl-2-methyl-, chloride (1:1)
CAS Number:
70862-65-6
Molecular Formula:
C24H47ClN2
Molecular Weight:
399.0964
IUPAC Name:
1,3-didecyl-2-methylimidazol-1-ium;chloride
InChI:
InChI=1S/C24H47N2.ClH/c1-4-6-8-10-12-14-16-18-20-25-22-23-26(24(25)3)21-19-17-15-13-11-9-7-5-2;/h22-23H,4-21H2,1-3H3;1H/q+1;/p-1
InChI Key:
GJYWPRKIEORZLX-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCn1cc[n+](c1C)CCCCCCCCCC.[Cl-]
EC Number:
274-948-0
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
398.343g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
399.104g/mol
Monoisotopic Mass:
398.343g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
8.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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