Cas no 7292-60-6 (6H-Purin-6-one,1,9-dihydro-9-(5-hydroxypentyl)-)
7292-60-6 structure
Product Name:6H-Purin-6-one,1,9-dihydro-9-(5-hydroxypentyl)-
CAS No:7292-60-6
MF:C10H14N4O2
MW:222.243761539459
CID:579254
PubChem ID:135459448
Update Time:2025-04-19
6H-Purin-6-one,1,9-dihydro-9-(5-hydroxypentyl)- Chemical and Physical Properties
Names and Identifiers
-
- 6H-Purin-6-one,1,9-dihydro-9-(5-hydroxypentyl)-
- 9-(5-hydroxypentyl)-3H-purin-6-one
- 5-(6-hydroxypurin-9-yl)pentanol
- 9-(5-hydroxypentyl)-3,9-dihydro-6h-purin-6-one
- 9-(5-hydroxypentyl)hypoxanthine
- 9-[5-Hydroxypentyl]hypoxanthine
- AC1L6JW6
- AC1Q6IEJ
- AR-1H5062
- CTK5D7061
- NSC159719
- NSC-159719
- DTXSID50303659
- SCHEMBL10362340
- 9-(5-Hydroxypentyl)-1H-purin-6(9H)-one
- LWABWZLZHWSPIN-UHFFFAOYSA-N
- 7292-60-6
- 9-(5-Hydroxypentyl)-1,9-dihydro-6H-purin-6-one #
- 9-(5-hydroxypentyl)-6,9-dihydro-1H-purin-6-one
-
- Inchi： 1S/C10H14N4O2/c15-5-3-1-2-4-14-7-13-8-9(14)11-6-12-10(8)16/h6-7,15H,1-5H2,(H,11,12,16)
- InChI Key： LWABWZLZHWSPIN-UHFFFAOYSA-N
- SMILES： OCCCCCN1C=NC2C(NC=NC1=2)=O
Computed Properties
- Exact Mass: 222.11182
- Monoisotopic Mass: 222.112
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 282
- 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: -0.2
- Topological Polar Surface Area: 79.5?2
Experimental Properties
- Density: 1.42
- Boiling Point: 512.5°Cat760mmHg
- Flash Point: 263.8°C
- Refractive Index: 1.67
- PSA: 79.51
- LogP: 0.28220
6H-Purin-6-one,1,9-dihydro-9-(5-hydroxypentyl)- Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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