4-Aza-5a-androstan-1-ene-3-one-17b-carboxylic acid (CAS 104239-97-6) — formula C19H27NO3, molecular weight 317.4; category organic chemicals.
| CAS Number | 104239-97-6 |
|---|---|
| Molecular Formula | C19H27NO3 |
| Molecular Weight | 317.4 |
| LogP | 2.3 |
| Category | Organic Chemicals |
4-Aza-5a-androstan-1-ene-3-one-17b-carboxylic acid is a carbon-based organic compound with CAS registry number 104239-97-6 and molecular formula C19H27NO3 (molecular weight 317.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 104239-97-6
Its molecular formula C19H27NO3 comprises 19 C, 27 H, 1 N, 3 O atoms.
Also known as: 4-Aza-5a-androstan-1-ene-3-one-17b-carboxylic acid · 4-氮杂-5a-雄甾烷-1-烯-3-酮-17b-羧酸
Category: organic chemicals
The CAS registry number of 4-Aza-5a-androstan-1-ene-3-one-17b-carboxylic acid is 104239-97-6.
Molecular formula C19H27NO3, molecular weight 317.4.
It is also registered under: 4-Aza-5a-androstan-1-ene-3-one-17b-carboxylic acid, 4-氮杂-5a-雄甾烷-1-烯-3-酮-17b-羧酸.
Category: Organic Chemicals.
Independent reference data for 4-Aza-5a-androstan-1-ene-3-one-17b-carboxylic acid (CAS 104239-97-6), compiled from public chemistry databases.
| CAS Registry Number | 104239-97-6 |
|---|---|
| PubChem CID | 9839970 |
| Molecular formula | C19H27NO3 |
| IUPAC name | (1S,3aS,3bS,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxylic acid |
| UNII (FDA) | 2E6A626D4R |
| Molecular Weight | 317.4 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 317.19909372 |
| Monoisotopic Mass | 317.19909372 |
| Topological Polar Surface Area | 66.4 |
| Heavy Atom Count | 23 |
104239-97-6; Dutasteride acid; 2E6A626D4R; DTXSID001238002; 3-Oxo-4-aza-5alpha-androst-1-ene-17beta-carboxylic acid; DUTASTERIDE IMPURITY A [EP IMPURITY]; 3-OXO-4-AZA-5.ALPHA.-ANDROST-1-ENE-17.BETA.-CARBOXYLIC ACID; DUTASTERIDE IMPURITY A (EP IMPURITY); RefChem:590473; DTXCID401668922; 600-542-3; 918-246-0; 4-Aza-5a-androstan-1-ene-3-one-17b-carboxylic acid; Dutasteride EP Impurity A; Finasteride Acid; MFCD08063794
| Reported hazard statements | H302 (95%), H361 (95%) |
|---|
H302 (95%): Harmful if swallowed [Warning Acute toxicity, oral]
H361 (95%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]
4-Aza-5a-androstan-1-ene-3-one-17b-carboxylic acid · CAS 104239-97-6 · C19H27NO3. UNII 2E6A626D4R.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.