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Molecule
Clordion
CAS: 302-22-7 · C23H29ClO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 302-22-7
- Molecular Formula
- C23H29ClO4
- Molecular Mass
- 404.93 g/mol
Identifiers
CAS Registry Number
302-22-7
SMILES
CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
InChI Key
QMBJSIBWORFWQT-DFXBJWIESA-N
InChI
InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h11-12,16-18H,5-10H2,1-4H3/t16-,17+,18+,21-,22+,23+/m1/s1
Names and Synonyms
- Clordion Synonym
- Retex Synonym
- Chlormadinone Acetate Synonym
- Pregna-4,6-diene-3,20-dione, 17-(acetyloxy)-6-chloro- Synonym
- 6-Chloro-pregna-4,6-dien-17α-ol-3,20-dione acetate Synonym
- 6-Dehydro-6-chloro-17α-acetoxyprogesterone Synonym
- Lormin Synonym
- Lutinyl Synonym
- Skedule TM Synonym
- Matrol Synonym
- 6-Chloro-17-hydroxypregna-4,6-diene-3,20-dione acetate Synonym
- Ay 13390-6 Synonym
- 6-Chloro-17α-hydroxy-4,6-pregnadiene-3,20-dione 17-acetate Synonym
- Gestafortin Synonym
- 6-Chloro-17α-acetoxy-4,6-pregnadiene-3,20-dione Synonym
- 6-Chloro-6,7-dehydro-17-acetoxyprogesterone Synonym
- 6-Chloro-Δ6-[17α]acetoxyprogesterone Synonym
- Chlormadinon acetate Synonym
- 17-Acetoxy-6-chloropregna-4,6-diene-3,20-dione Synonym
- 17α-Acetoxy-6-chloro-6,7-dehydroprogesterone Synonym
- Luteran Synonym
- Lutoral (Syntex) Synonym
- Normenon Synonym
- Menstridyl Synonym
- Cero Synonym
- Verton Synonym
- 17α-Acetoxy-6-chloro-4,6-pregnadiene-3,20-dione Synonym
- Synchrosyn P Synonym
- Bovisynchron Synonym
- Traslan Synonym
- Synchrosyn Synonym
- Prostal Synonym
- NSC 92338 Synonym
- Natrol Synonym
- Lutoral Synonym
- Fertiletten Synonym
- Chronosyn Synonym
- Cyclonorm Synonym
- Bellissima Synonym
- Pregna-4,6-diene-3,20-dione, 6-chloro-17-hydroxy-, acetate Synonym
- 17-(Acetyloxy)-6-chloropregna-4,6-diene-3,20-dione Synonym
- RS 1280 Synonym
- 17-Acetoxy-6-chloro-6-dehydroprogesterone Synonym
- CAP Synonym
- Chlormadinone acetate Synonym
- 6-Chloro-17-acetoxy-4,6-pregnadiene-3,20-dione Synonym
- 6-Chloro-Δ6-17-acetoxyprogesterone Synonym
- 6-Chloro-Δ6-dehydro-17-acetoxyprogesterone Synonym
- 6-Chloro-6-dehydro-17-acetoxyprogesterone Synonym
- 6-Chloro-6-dehydro-17α-acetoxyprogesterone Synonym
- 6-Chloro-17α-hydroxypregna-4,6-diene-3,20-dione acetate Synonym
- 6-Chloro-17α-hydroxy-Δ6-progesterone acetate Synonym
- 6-Chloro-Δ4,6-pregnadien-17α-ol-3,20-dione 17-acetate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 404.93 g/mol | CAS Common Chemistry |
| 404.9340000000003 g/mol | RDKit | |
| 404.934 g/mol | RDKit | |
| 404.931 g/mol | chempirical lib | |
| Canonical SMILES | O=C(OC1(C(=O)C)CCC2C3C=C(Cl)C4=CC(=O)CCC4(C)C3CCC21C)C | CAS Common Chemistry |
| InChI | InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h11-12,16-18H,5-10H2,1-4H3/t16-,17+,18+,21-,22+,23+/m1/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=QMBJSIBWORFWQT-DFXBJWIESA-N | CAS Common Chemistry |
| Melting Point | 212-214 °C | CAS Common Chemistry |
| Name | Chlormadinone acetate | CAS Common Chemistry |
| Heavy Atom Count | 28 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 60.440000000000005 Ų | RDKit |
| 60.44 Ų | RDKit | |
| LogP | 4.751700000000005 | RDKit |
| 4.7517 | RDKit | |
| Molar Refractivity | 106.59000000000006 cm³/mol | RDKit |
| Ring Count | 4 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.6957 | RDKit |
| 0.7 | chempirical lib | |
| Exact Mass | 404.175437088 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 404.93 g/mol. Edit any field — others recompute live.
