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119154-05-1

119154-05-1 | 2H-Isoindole-2-acetic acid, 1,3-dihydro-1,3-dioxo-, tributylstannyl ester

CAS No: 119154-05-1 Catalog No: AG000IA7 MDL No:

Product Description

Catalog Number:
AG000IA7
Chemical Name:
2H-Isoindole-2-acetic acid, 1,3-dihydro-1,3-dioxo-, tributylstannyl ester
CAS Number:
119154-05-1
Molecular Formula:
C22H33NO4Sn
Molecular Weight:
494.2027
IUPAC Name:
tributylstannyl 2-(1,3-dioxoisoindol-2-yl)acetate
InChI:
InChI=1S/C10H7NO4.3C4H9.Sn/c12-8(13)5-11-9(14)6-3-1-2-4-7(6)10(11)15;3*1-3-4-2;/h1-4H,5H2,(H,12,13);3*1,3-4H2,2H3;/q;;;;+1/p-1
InChI Key:
NMBMWKBWJHSXKA-UHFFFAOYSA-M
SMILES:
CCCC[Sn](OC(=O)CN1C(=O)c2c(C1=O)cccc2)(CCCC)CCCC

Properties

Complexity:
505  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
495.143g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
494.219g/mol
Monoisotopic Mass:
495.143g/mol
Rotatable Bond Count:
13  
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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