Registration Dossier
Registration Dossier
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The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.
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EC number: 944-146-1 | CAS number: -
Reference substances
- IUPAC name:
- Reaction mass of (6alpha,11beta)-11,17-dihydroxy-21-iodo-6-methylpregna-1,4-diene-3,20-dione and (6alpha,11beta)-11,17-dihydroxy-21,21-diiodo-6-methylpregna-1,4-diene-3,20-dione
Inventory
Synonyms
- Names:
- Identifier:
- CAS number
- 85847-53-6
- Identifier:
- CAS number
- 94134-96-0
- Identifier:
- IUPAC name
- (6α,11β)-11,17-dihydroxy-21,21-diiodo-6-methylpregna-1,4-diene-3,20-dione
- Identifier:
- IUPAC name
- (6α,11β)-11,17-dihydroxy-21-iodo-6-methylpregna-1,4-diene-3,20-dione
Molecular and structural information
- Molecular formula:
- not identified
- Structural formula:
Related substances
open allclose all
- Identifier:
- IUPAC name
- Identity:
- (6α,11β)-11,17-dihydroxy-21,21-diiodo-6-methylpregna-1,4-diene-3,20-dione
- Identifier:
- CAS number
- Identity:
- 94134-96-0
- Identifier:
- EC number
- Identity:
- 302-866-8
- Identifier:
- other: molecular formula
- Identity:
- C22H28I2O4
- Identifier:
- other: molecular weight
- Identity:
- 610.26
- Identifier:
- other: Smile notation:
- Identity:
- IC(I)C(=O)[C@@]4(O)CC[C@@H]3[C@]4(C)C[C@H](O)[C@H]2[C@H]3C[C@H](C)C1=CC(=O)C=C[C@@]12C
- Identifier:
- other: InChI Code
- Identity:
- InChI=1S/C22H28I2O4/c1-11-8-13-14-5-7-22(28,18(27)19(23)24)21(14,3)10-16(26)17(13)20(2)6-4-12(25)9-15(11)20/h4,6,9,11,13-14,16-17,19,26,28H,5,7-8,10H2,1-3H3/t11-,13-,14-,16-,17+,20-,21-,22-/m0/s1
- Identifier:
- IUPAC name
- Identity:
- (6α,11β)-11,17-dihydroxy-21-iodo-6-methylpregna-1,4-diene-3,20-dione
- Identifier:
- other: molecular weight
- Identity:
- 484.37
- Identifier:
- other: molecular formula
- Identity:
- C22H29IO4
- Identifier:
- other: SMILES notation
- Identity:
- ICC(=O)[C@@]4(O)CC[C@@H]3[C@]4©C[C@H](O)[C@H]2[C@H]3C[C@H]©C1=CC(=O)C=C[C@@]12C
- Identifier:
- other: InChI code
- Identity:
- InChI=1S/C22H29IO4/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,25,27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,17-,19+,20-,21-,22-/m0/s1
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