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(4S,4'S)-2,2'-(2-(Trimethylstannyl)-1,3-phenylene)bis(4-isopropyl-4,5-dihydrooxazole)

Catalog Number ACM196407815
CAS 196407-81-5
Synonyms [2,6-Bis[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-trimethylstannane
Molecular Weight 463.2
Molecular Formula C21H32N2O2Sn
Canonical SMILES CC(C)C1COC(=N1)C2=C(C(=CC=C2)C3=NC(CO3)C(C)C)[Sn](C)(C)C
InChI InChI=1S/C18H23N2O2.3CH3.Sn/c1-11(2)15-9-21-17(19-15)13-6-5-7-14(8-13)18-20-16(10-22-18)12(3)4;/h5-7,11-12,15-16H,9-10H2,1-4H3;3*1H3;/t15-,16-;/m1/s1
InChI Key LDJSGJPVVSXPQU-WOLYCILSSA-N
Purity 98%
Exact Mass 464.148581
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
Isomeric SMILES CC(C)[C@H]1COC(=N1)C2=C(C(=CC=C2)C3=N[C@H](CO3)C(C)C)[Sn](C)(C)C
Monoisotopic Mass 464.148581
Rotatable Bond Count 5
Topological Polar Surface Area 43.2 Ų

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