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141993-06-8 | Phenol, 4-[5-(tributylstannyl)-3-isoxazolyl]-
CAS No: 141993-06-8 Catalog No: AG001HII MDL No:
Product Description
Catalog Number:
AG001HII
Chemical Name:
Phenol, 4-[5-(tributylstannyl)-3-isoxazolyl]-
CAS Number:
141993-06-8
Molecular Formula:
C21H33NO2Sn
Molecular Weight:
450.1932
IUPAC Name:
4-(5-tributylstannyl-1,2-oxazol-3-yl)phenol
InChI:
InChI=1S/C9H6NO2.3C4H9.Sn/c11-8-3-1-7(2-4-8)9-5-6-12-10-9;3*1-3-4-2;/h1-5,11H;3*1,3-4H2,2H3;
InChI Key:
SBAZAXFALXAJDB-UHFFFAOYSA-N
SMILES:
CCCC[Sn](c1onc(c1)c1ccc(cc1)O)(CCCC)CCCC
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
451.153g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
450.21g/mol
Monoisotopic Mass:
451.153g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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