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70892-78-3 | 1-[2-[(Sodiooxycarbonyl)methoxy]ethyl]-4,5-dihydro-3-[2-hydroxy-3-(sodiosulfo)propyl]-2-undecyl-1H-imidazol-3-ium
CAS No: 70892-78-3 Catalog No: AG00FUG0 MDL No:
Product Description
Catalog Number:
AG00FUG0
Chemical Name:
1-[2-[(Sodiooxycarbonyl)methoxy]ethyl]-4,5-dihydro-3-[2-hydroxy-3-(sodiosulfo)propyl]-2-undecyl-1H-imidazol-3-ium
CAS Number:
70892-78-3
IUPAC Name:
disodium;2-[2-[3-(2-hydroxy-3-sulfonatopropyl)-2-undecyl-4,5-dihydroimidazol-3-ium-1-yl]ethoxy]acetate;hydroxide
InChI:
InChI=1S/C21H40N2O7S.2Na.H2O/c1-2-3-4-5-6-7-8-9-10-11-20-22(14-15-30-17-21(25)26)12-13-23(20)16-19(24)18-31(27,28)29;;;/h19,24H,2-18H2,1H3,(H-,25,26,27,28,29);;;1H2/q;2*+1;/p-2
InChI Key:
MXXMQMMJMQHOJZ-UHFFFAOYSA-L
Properties
Complexity:
628
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
526.23g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
526.597g/mol
Monoisotopic Mass:
526.23g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
142A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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