16alpha-(125I)Iodoestradiol

Base Information

• Chemical Name: 16alpha-(125I)Iodoestradiol
• CAS No.: 71765-93-0
• Molecular Formula: C18H23IO2
• Molecular Weight: 396.2786
• UNII: QEE8L28C30
• DSSTox Substance ID: DTXSID50992421
• Wikidata: Q82982579

Synonyms:71765-93-0;QEE8L28C30;16alpha-(125I)Iodoestradiol;16alpha-Iodo-17beta-estradiol-125I;UNII-QEE8L28C30;16alpha-Iodoestradiol I-125;DTXSID50992421;16-alpha-(Iodo-(125)I)estra-1,3,5(10)-triene-3,17-beta-diol;Estra-1,3,5(10)-triene-3,17-diol, 16-(iodo-125I)-, (16alpha,17beta)-;16.ALPHA.-(125I)IODOESTRADIOL;16.ALPHA.-IODOESTRADIOL I-125;16.ALPHA.-IODO-17.BETA.-ESTRADIOL-125I;16-(~125~I)Iodoestra-1(10),2,4-triene-3,17-diol;(16.ALPHA.,17.BETA.)-16-(IODO-125I)ESTRA-1,3,5(10)-TRIENE-3,17-DIOL;ESTRA-1,3,5(10)-TRIENE-3,17-DIOL, 16-(IODO-125I)-, (16.ALPHA.,17.BETA.)-

Chemical Property of 16alpha-(125I)Iodoestradiol

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.6g/cm³
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 396.07444
• Heavy Atom Count: 21
• Complexity: 414

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC3C(C1CC(C2O)I)CCC4=C3C=CC(=C4)O
• Isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2O)[125I])CCC4=C3C=CC(=C4)O

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