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79330-84-0

79330-84-0 | 8-Oxa-3,5-dithia-4-stannadocosanoicacid, 4,4-dioctyl-7-oxo-, tetradecyl ester

CAS No: 79330-84-0 Catalog No: AG005KDS MDL No:

Product Description

Catalog Number:
AG005KDS
Chemical Name:
8-Oxa-3,5-dithia-4-stannadocosanoicacid, 4,4-dioctyl-7-oxo-, tetradecyl ester
CAS Number:
79330-84-0
Molecular Formula:
C48H96O4S2Sn
Molecular Weight:
920.1044
IUPAC Name:
tetradecyl 2-[dioctyl-(2-oxo-2-tetradecoxyethyl)sulfanylstannyl]sulfanylacetate
InChI:
InChI=1S/2C16H32O2S.2C8H17.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-16(17)15-19;2*1-3-5-7-8-6-4-2;/h2*19H,2-15H2,1H3;2*1,3-8H2,2H3;/q;;;;+2/p-2
InChI Key:
GFISNEOJVVUFMW-UHFFFAOYSA-L
SMILES:
CCCCCCCC[Sn](SCC(=O)OCCCCCCCCCCCCCC)(SCC(=O)OCCCCCCCCCCCCCC)CCCCCCCC
EC Number:
279-134-9

Properties

Complexity:
734  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
920.577g/mol
Formal Charge:
0
Heavy Atom Count:
55  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
920.122g/mol
Monoisotopic Mass:
920.577g/mol
Rotatable Bond Count:
48  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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