Cas no 87517-56-4 (Hexanoic acid, 5-oxo-6-phosphono-)
87517-56-4 structure
Product Name:Hexanoic acid, 5-oxo-6-phosphono-
CAS No:87517-56-4
MF:C6H11O6P
MW:210.121703386307
CID:655583
PubChem ID:13202490
Update Time:2025-04-19
Hexanoic acid, 5-oxo-6-phosphono- Chemical and Physical Properties
Names and Identifiers
-
- Hexanoic acid, 5-oxo-6-phosphono-
- 5-oxo-6-phosphonohexanoic acid
- DTXSID90527175
- 87517-56-4
-
- Inchi： 1S/C6H11O6P/c7-5(4-13(10,11)12)2-1-3-6(8)9/h1-4H2,(H,8,9)(H2,10,11,12)
- InChI Key： LIQOGMDXRQJZDI-UHFFFAOYSA-N
- SMILES： P(CC(CCCC(=O)O)=O)(=O)(O)O
Computed Properties
- Exact Mass: 210.02932506g/mol
- Monoisotopic Mass: 210.02932506g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 13
- Rotatable Bond Count: 6
- Complexity: 242
- 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: -2.1
- Topological Polar Surface Area: 112?2
Hexanoic acid, 5-oxo-6-phosphono- Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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