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S-3,3'-Bis(phenyl)-1,1'-binaphthyl-2,2'-diyl hydrogenphosphate

Catalog Number ACM874948591-1
CAS 874948-59-1
Structure S-3,3'-Bis(phenyl)-1,1'-binaphthyl-2,2'-diyl hydrogenphosphate
Synonyms (11bS)-4-Hydroxy-2,6-diphenyldinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-oxide
IUPAC Name 13-hydroxy-10,16-diphenyl-12,14-dioxa-13-5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 13-oxide
Molecular Weight 500.48
Molecular Formula C32H21O4P
Canonical SMILES C1=CC=C(C=C1)C2=CC3=CC=CC=C3C4=C2OP(=O)(OC5=C4C6=CC=CC=C6C=C5C7=CC=CC=C7)O
InChI RLPAIZCRXBEKDM-UHFFFAOYSA-N
InChI Key InChI=1S/C32H21O4P/c33-37(34)35-31-27(21-11-3-1-4-12-21)19-23-15-7-9-17-25(23)29(31)30-26-18-10-8-16-24(26)20-28(32(30)36-37)22-13-5-2-6-14-22/h1-20H,(H,33,34)
Boiling Point 755.1±70.0 °C(Predicted)
Exact Mass 500.11774614
Heavy Atom Count 37
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
Monoisotopic Mass 500.11774614
Rotatable Bond Count 2
Topological Polar Surface Area 55.8 Ų

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