Almestrone
Also known as Almestrona, 7alpha-Methylestrone, Almestronum
Key facts
What buyers check first
- CAS number
- 10448-96-1
- Formula
- C19H24O2
- Molar mass
- 284.40 g/mol
- EC number
- 686-274-8
- HS code
- 291450
- Category
- Steroids and sterols
What is Almestrone?
Plain description, key identifiers and synonyms
Almestrone is a chemical substance with the molecular formula C19H24O2 and a molar mass of 284.40 g/mol. Its CAS registry number is 10448-96-1. The IUPAC name is (7R,8R,9S,13S,14S)-3-hydroxy-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (7R,8R,9S,13S,14S)-3-hydroxy-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
- CAS number
- 10448-96-1 CAS number cross-checked
- EC number
- 686-274-8
- Molecular formula
- C19H24O2
- UNII
- N18A31MTB0
- InChIKey
- JUAJXSMWFOFDFC-MNHDCVOLSA-N
- InChI
- InChI=1S/C19H24O2/c1-11-9-12-10-13(20)3-4-14(12)15-7-8-19(2)16(18(11)15)5-6-17(19)21/h3-4,10-11,15-16,18,20H,5-9H2,1-2H3/t11-,15-,16+,18-,19+/m1/s1
- Canonical SMILES
- CC1Cc2cc(O)ccc2C2CCC3(C)C(=O)CCC3C12
- Isomeric SMILES
- C[C@@H]1CC2=C(C=CC(=C2)O)[C@@H]3[C@@H]1[C@@H]4CCC(=O)[C@]4(CC3)C
Synonyms
- Almestrona
- 7alpha-Methylestrone
- Almestronum
- Ba 38372
- 3-Hydroxy-7alpha-methylestra-1,3,5(10)-trien-17-one
- Almestronum (INN-Latin)
- Almestrona (INN-Spanish)
- Estra-1,3,5(10)-trien-17-one, 3-hydroxy-7alpha-methyl-
- Estra-1,3,5(10)-trien-17-one, 3-hydroxy-7alpha-methyl-(8CI)
- (7R,8R,9S,13S,14S)-3-hydroxy-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
- 7-Methyl-estrone
- Estra-1,3,5(10)-trien-17-one,3-hydroxy-7-methyl-, (7a)-
- 3-hydroxy-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
- 7a-methyl-3-hydroxy-1,3,5(10)-estratrien-17-one
- 3-Hydroxy-7alpha-methylestra-1(10),2,4-trien-17-one
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 284.40 g/molcalc.Computed value |
|---|---|
| Exact mass | 284.1776 Dacalc.Computed value |
| LogP (octanol/water) | 4.06calc.Computed value |
| Topological polar surface area | 37.3 Ųcalc.Computed value |
| Hydrogen bond donors | 1calc.Computed value |
| Hydrogen bond acceptors | 2calc.Computed value |
| Rotatable bonds | 0calc.Computed value |
| Heavy atoms | 21calc.Computed value |
| Rings | 4calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.63calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 5calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H302Harmful if swallowed.
- H312Harmful in contact with skin.
- H332Harmful if inhaled.
- H351Suspected of causing cancer.
- H361Suspected of damaging fertility or the unborn child.
- H412Harmful to aquatic life with long lasting effects.
Precautionary statements (17)
- P203Obtain, read and follow all safety instructions before use.
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P264Wash skin thoroughly after handling.
- P270Do not eat, drink or smoke when using this product.
- P271Use only outdoors or in a well-ventilated area.
- P273Avoid release to the environment.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P301 + P317If swallowed: Get medical help.
- P302 + P352If on skin: Wash with plenty of water.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P317Get medical help.
- P318If exposed or concerned, get medical advice.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- P405Store locked up.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidAlmestrone suppliers
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Almestrone price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Almestrone is traded under.
Ketone-phenols and ketones with other oxygen function
- China50.5%
- India * partner reported11.6%
- United States11.3%
- United States20.8%
- Germany10.0%
- Netherlands8.6%
* Partner reported figures, a lower bound.
The HS code shown for Almestrone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Almestrone, based on the data on this page
What is Almestrone?
What is the CAS number of Almestrone?
What is the molecular formula and weight of Almestrone?
Is Almestrone hazardous?
What is the HS code of Almestrone?
Where can I buy Almestrone?
What is the price of Almestrone?
Guides for buyers
Practical guides that help when you source, ship or handle Almestrone
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
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