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130352-63-5 | 1,4-Naphthalenedione, 2-butyl-3-(tributylstannyl)-
CAS No: 130352-63-5 Catalog No: AG000UAY MDL No:
Product Description
Catalog Number:
AG000UAY
Chemical Name:
1,4-Naphthalenedione, 2-butyl-3-(tributylstannyl)-
CAS Number:
130352-63-5
Molecular Formula:
C26H40O2Sn
Molecular Weight:
503.2956
IUPAC Name:
2-butyl-3-tributylstannylnaphthalene-1,4-dione
InChI:
InChI=1S/C14H13O2.3C4H9.Sn/c1-2-3-6-10-9-13(15)11-7-4-5-8-12(11)14(10)16;3*1-3-4-2;/h4-5,7-8H,2-3,6H2,1H3;3*1,3-4H2,2H3;
InChI Key:
AXMBUEORYOOCOI-UHFFFAOYSA-N
SMILES:
CCCCC1=C(C(=O)c2c(C1=O)cccc2)[Sn](CCCC)(CCCC)CCCC
Properties
Complexity:
556
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
504.205g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
503.314g/mol
Monoisotopic Mass:
504.205g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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