Benzoic acid, 3,4,5-trimethoxy-, 2,6-pyridinediylbis(methylene) ester


Chemical Name: Benzoic acid, 3,4,5-trimethoxy-, 2,6-pyridinediylbis(methylene) ester
CAS Number: 54110-25-7
Product Number: AG00DETS(AGN-PC-0SGLJ8)
Synonyms:
MDL No:
Molecular Formula: C27H29NO10
Molecular Weight: 527.5199

Identification/Properties


Computed Properties
Molecular Weight:
527.526g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
14
Exact Mass:
527.179g/mol
Monoisotopic Mass:
527.179g/mol
Topological Polar Surface Area:
121A^2
Heavy Atom Count:
38
Formal Charge:
0
Complexity:
653
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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