Diethylaminoethoxyhexestrol dihydrochloride
Basic information
- CAS
69-14-7- Standard SMILES
CCC(c1ccc(OCCN(CC)CC)cc1)C(CC)c1ccc(OCCN(CC)CC)cc1.Cl.Cl- InChIKey
SIZRPIFUDMQNNJ-UHFFFAOYSA-N- Molecular formula
- C30H50Cl2N2O2
- Average molar mass
- 541.6 g/mol
- Monoisotopic mass
- 540.3249342
Names & identifiers
- Preferred name
- Diethylaminoethoxyhexestrol dihydrochloride
- IUPAC
- 2-[4-[4-[4-[2-(diethylamino)ethoxy]phenyl]hexan-3-yl]phenoxy]-N,N-diethylethanamine;dihydrochloride
- English name
- Coralgil
- Molecular formula
- C30H48N2O2
- Molecular weight
- 0
Names & synonyms
CoralginaDiaethiphenumAltelideCarifolminCoralgylCoronastinDiethylphenKoralgilTrimanilEtafenEtaphenTrimanylane dihydrochloride
Show more names
CoralgilDiethylaminoethoxyhexestrol hydrochloride2,2'-[3,4-Hexanediylbis(4,1-phenyleneoxy)]-bis(N,N-diethylethanamine)2,2'-((Hexane-3,4-diylbis(4,1-phenylene))bis(oxy))bis(N,N-diethylethan-1-amine) dihydrochloride
WU18TJT1QVCORAGILDIETHIPHENDIETHYPHEN4,4'-Diethylaminoethoxyhexestrol dihydrochloridediethylaminoethoxyhexestrol dihydrochlorideHexestrol bis(2-diethylaminoethyl)ether dihydrochlorideMG-345
Database identifiers
- CAS
69-14-7- PubChem CID
- 66142
- DTXSID
DTXSID40988757- UNII
- WU18TJT1QV
Properties
Computed structural properties
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 434
Physicochemical properties
- Melting point
- 226 · 226-227°
- FDA UNII
- 18 TJT1QV · WU18TJT1QV
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationDrugs used to cause dilation of the blood vessels.
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Compound notes
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