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14934-37-3 | 3,3'-DIETHYL-9-METHYLOXACARBOCYANINE IODIDE
CAS No: 14934-37-3 Catalog No: AG00AZG2 MDL No:
Product Description
Catalog Number:
AG00AZG2
Chemical Name:
3,3'-DIETHYL-9-METHYLOXACARBOCYANINE IODIDE
CAS Number:
14934-37-3
IUPAC Name:
3-ethyl-2-[3-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)-2-methylprop-2-enylidene]-1,3-benzoxazole;iodide
InChI:
InChI=1S/C22H23N2O2.HI/c1-4-23-17-10-6-8-12-19(17)25-21(23)14-16(3)15-22-24(5-2)18-11-7-9-13-20(18)26-22;/h6-15H,4-5H2,1-3H3;1H/q+1;/p-1
InChI Key:
SGSAYBUVQALYJE-UHFFFAOYSA-M
EC Number:
239-009-1
Properties
Complexity:
511
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
474.08g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
474.342g/mol
Monoisotopic Mass:
474.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
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