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Dibutylbis(4-((S)-4-isopropyl-4,5-dihydrooxazol-2-yl)phenyl)stannane

Catalog Number ACM823795966
CAS 823795-96-6
Synonyms Dibutyl-bis[4-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]stannane
Molecular Weight 609.43
Molecular Formula C32H46N2O2Sn
Canonical SMILES CCCC[Sn](CCCC)(C1=CC=C(C=C1)C2=NC(CO2)C(C)C)C3=CC=C(C=C3)C4=NC(CO4)C(C)C
InChI InChI=1S/2C12H14NO.2C4H9.Sn/c2*1-9(2)11-8-14-12(13-11)10-6-4-3-5-7-10;2*1-3-4-2;/h2*4-7,9,11H,8H2,1-2H3;2*1,3-4H2,2H3;/t2*11-;/m11/s1
InChI Key ZJGCBOIHIZGUFO-WYGNBYAASA-N
Purity 98%
Exact Mass 610.258131
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
Isomeric SMILES CCCC[Sn](CCCC)(C1=CC=C(C=C1)C2=N[C@H](CO2)C(C)C)C3=CC=C(C=C3)C4=N[C@H](CO4)C(C)C
Monoisotopic Mass 610.258131
Rotatable Bond Count 12
Topological Polar Surface Area 43.2 Ų

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