Cas no 55242-58-5 (3-Methyl-7-(5-oxohexyl)-1-propylxanthine)
55242-58-5 structure
Product Name:3-Methyl-7-(5-oxohexyl)-1-propylxanthine
CAS No:55242-58-5
MF:C15H22N4O3
MW:306.360183238983
CID:1063753
PubChem ID:12902748
Update Time:2025-04-20
3-Methyl-7-(5-oxohexyl)-1-propylxanthine Chemical and Physical Properties
Names and Identifiers
-
- 3-Methyl-7-(5-oxohexyl)-1-propylxanthine
- 3-methyl-7-(5-oxohexyl)-1-propylpurine-2,6-dione
- starbld0001947
- 1-n-Propyl-3-methyl-7-(5-oxohexyl)-xanthine
- DTXSID70512589
- DB-228717
- 3-Methyl-7-(5-oxohexyl)-1-propyl-3,7-dihydro-1H-purine-2,6-dione
- SCHEMBL7800864
- 55242-58-5
- SCWBBXYWLYSKGK-UHFFFAOYSA-N
-
- Inchi: 1S/C15H22N4O3/c1-4-8-19-14(21)12-13(17(3)15(19)22)16-10-18(12)9-6-5-7-11(2)20/h10H,4-9H2,1-3H3
- InChI Key: SCWBBXYWLYSKGK-UHFFFAOYSA-N
- SMILES: O=C1C2=C(N=CN2CCCCC(C)=O)N(C)C(N1CCC)=O
Computed Properties
- Exact Mass: 306.16919058g/mol
- Monoisotopic Mass: 306.16919058g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 7
- Complexity: 454
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.7
- Topological Polar Surface Area: 75.5?2
Experimental Properties
- Density: 1.3±0.1 g/cm3
- Boiling Point: 537.9±56.0 °C at 760 mmHg
- Flash Point: 279.1±31.8 °C
- Vapor Pressure: 0.0±1.4 mmHg at 25°C
3-Methyl-7-(5-oxohexyl)-1-propylxanthine Security Information
- Signal Word:warning
- Hazard Statement: H303+H313+H333
- Warning Statement: P264+P280+P305+P351+P338+P337+P313
- Safety Instruction: H303+H313+H333
- Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
3-Methyl-7-(5-oxohexyl)-1-propylxanthine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | M325640-100mg |
3-Methyl-7-(5-oxohexyl)-1-propylxanthine |
55242-58-5 | 100mg |
$ 196.00 | 2023-04-17 | ||
| TRC | M325640-1g |
3-Methyl-7-(5-oxohexyl)-1-propylxanthine |
55242-58-5 | 1g |
$ 1533.00 | 2023-04-17 |
3-Methyl-7-(5-oxohexyl)-1-propylxanthine Related Literature
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
Camelia Henríquez,Edwin Palacio,Víctor Cerdà Anal. Methods, 2014,6, 8494-8504
-
Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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