Aminoestradiol

Base Information

• Chemical Name: Aminoestradiol
• CAS No.: 20989-33-7
• Molecular Formula: C₁₈H₂₅NO
• Molecular Weight: 271.403
• UNII: 566D62CJB8
• DSSTox Substance ID: DTXSID401337012
• Nikkaji Number: J1.037.070A
• Wikipedia: Aminoestradiol
• Mol file: 20989-33-7.mol

Synonyms:aminoestradiol;17betaAE2;17beta-Aminoestradiol;566D62CJB8;UNII-566D62CJB8;(17beta)-17-Aminoestra-1,3,5(10)-trien-3-ol;17beta-Aminoestradiol (17betaae2);17beta-Aminoestra-1,3,5(10)-trien-3-ol;Estra-1,3,5(10)-trien-3-ol, 17beta-amino-;(+)-17beta-Aminoestra-1,3,5(10)-trien-3-ol;D-17beta-amino-3-hydroxy-1,3,5(10)-estratriene;20989-33-7;17.BETA.AE2;SCHEMBL6257776;17.BETA.-AMINOESTRADIOL;VPONVJPFULJPAN-ZBRFXRBCSA-N;DTXSID401337012;17-Aminoestra-1,3,5(10)-trien-3-ol #;17beta-Aminoestra-1(10),2,4-triene-3-ol;17.BETA.-AMINOESTRADIOL (17.BETA.AE2);3-Hydroxy-17-.beta.-aminoestra-1,3,5(10)-triene;17.BETA.-AMINOESTRA-1,3,5(10)-TRIEN-3-OL;Estra-1,3,5(10)-trien-3-ol, 17-amino-, (17beta)-;ESTRA-1,3,5(10)-TRIEN-3-OL, 17.BETA.-AMINO-;(+)-17.BETA.-AMINOESTRA-1,3,5(10)-TRIEN-3-OL;(17.BETA.)-17-AMINOESTRA-1,3,5(10)-TRIEN-3-OL;D-17.BETA.-AMINO-3-HYDROXY-1,3,5(10)-ESTRATRIENE;ESTRA-1,3,5(10)-TRIEN-3-OL, 17-AMINO-, (17.BETA.)-

Chemical Property of Aminoestradiol

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 271.193614421
• Heavy Atom Count: 20
• Complexity: 384

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC12CCC3C(C1CCC2N)CCC4=C3C=CC(=C4)O
• Isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2N)CCC4=C3C=CC(=C4)O