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139954-19-1 | Pyrrolidine, 1-[[2-(chlorodimethylstannyl)-4-methylphenyl]sulfonyl]-
CAS No: 139954-19-1 Catalog No: AG001BUL MDL No:
Product Description
Catalog Number:
AG001BUL
Chemical Name:
Pyrrolidine, 1-[[2-(chlorodimethylstannyl)-4-methylphenyl]sulfonyl]-
CAS Number:
139954-19-1
Molecular Formula:
C13H20ClNO2SSn
Molecular Weight:
408.5224
IUPAC Name:
chloro-dimethyl-(5-methyl-2-pyrrolidin-1-ylsulfonylphenyl)stannane
InChI:
InChI=1S/C11H14NO2S.2CH3.ClH.Sn/c1-10-4-6-11(7-5-10)15(13,14)12-8-2-3-9-12;;;;/h4-6H,2-3,8-9H2,1H3;2*1H3;1H;/q;;;;+1/p-1
InChI Key:
RCTODSBDRFTTCS-UHFFFAOYSA-M
SMILES:
Cc1ccc(c(c1)[Sn](Cl)(C)C)S(=O)(=O)N1CCCC1
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.993g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
408.528g/mol
Monoisotopic Mass:
408.993g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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