Estra-1,3,5(10)-trien-17-aminium, 3-(2-(diethylmethylammonio)ethoxy)-N,N,N-trimethyl-, diiodide, (17-beta)-

Base Information

• Chemical Name: Estra-1,3,5(10)-trien-17-aminium, 3-(2-(diethylmethylammonio)ethoxy)-N,N,N-trimethyl-, diiodide, (17-beta)-
• CAS No.: 142575-14-2
• Molecular Formula: C28H48 N2 O . 2 I
• Molecular Weight: 682.5025
• DSSTox Substance ID: DTXSID30931530
• Mol file: 142575-14-2.mol

Synonyms:142575-14-2;Estra-1,3,5(10)-trien-17-aminium, 3-(2-(diethylmethylammonio)ethoxy)-N,N,N-trimethyl-, diiodide, (17-beta)-;DTXSID30931530;C28H48N2O.2I;C28-H48-N2-O.2I;LS-64750;3-{2-[Diethyl(methyl)azaniumyl]ethoxy}-N,N,N-trimethylestra-1(10),2,4-trien-17-aminium diiodide

Chemical Property of Estra-1,3,5(10)-trien-17-aminium, 3-(2-(diethylmethylammonio)ethoxy)-N,N,N-trimethyl-, diiodide, (17-beta)-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 682.18561
• Heavy Atom Count: 33
• Complexity: 609

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC[N+](C)(CC)CCOC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4[N+](C)(C)C)C.[I-].[I-]
• Isomeric SMILES: CC[N+](C)(CC)CCOC1=CC2=C(C=C1)[C@H]3CC[C@]4([C@H]([C@@H]3CC2)CC[C@@H]4[N+](C)(C)C)C.[I-].[I-]