Cas no 140447-17-2 (Cyclopentanebutanoic acid, 2-(4-hydroxy-2-pentenyl)-3-oxo-)
140447-17-2 structure
Product Name:Cyclopentanebutanoic acid, 2-(4-hydroxy-2-pentenyl)-3-oxo-
CAS No:140447-17-2
MF:C14H22O4
MW:254.322084903717
CID:1298391
PubChem ID:71343294
Update Time:2025-04-20
Cyclopentanebutanoic acid, 2-(4-hydroxy-2-pentenyl)-3-oxo- Chemical and Physical Properties
Names and Identifiers
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- Cyclopentanebutanoic acid, 2-(4-hydroxy-2-pentenyl)-3-oxo-
- 4-[2-(4-hydroxypent-2-enyl)-3-oxocyclopentyl]butanoic acid
- 140447-17-2
- DTXSID70769910
- 4-[2-(4-Hydroxypent-2-en-1-yl)-3-oxocyclopentyl]butanoic acid
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- Inchi： 1S/C14H22O4/c1-10(15)4-2-6-12-11(8-9-13(12)16)5-3-7-14(17)18/h2,4,10-12,15H,3,5-9H2,1H3,(H,17,18)
- InChI Key： PXFGJCCEZSDTQK-UHFFFAOYSA-N
- SMILES： O=C1CCC(CCCC(=O)O)C1CC=CC(C)O
Computed Properties
- Exact Mass: 254.15186
- Monoisotopic Mass: 254.15180918g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 7
- Complexity: 322
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 1.2
- Topological Polar Surface Area: 74.6?2
Experimental Properties
- PSA: 74.6
Cyclopentanebutanoic acid, 2-(4-hydroxy-2-pentenyl)-3-oxo- Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
140447-17-2 (Cyclopentanebutanoic acid, 2-(4-hydroxy-2-pentenyl)-3-oxo-) Related Products
- 27415-25-4(8-Isoprostaglandin E2)
- 21003-46-3(8-Isoprostaglandin E1)
- 363-24-6(Prostaglandin E2)
- 745-65-3(Prostaglandin E1)
- 24570-01-2(11-Epiprostaglandin E1)
- 38873-82-4(15(R)\u200b-\u200bProstaglandin E2)
- 38310-90-6(Prosta-5,13-dien-1-oicacid, 11,15-dihydroxy-9-oxo-, (5Z,11b,13E,15S)- (9CI))
- 37786-00-8(Prost-13-en-1-oic acid,15-hydroxy-9-oxo-, (13E,15S)-)
- 36150-00-2(5-trans-Prostaglandin E2)
- 119008-22-9(5,6-DIHYDRO PGE3)
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