Cas no 125441-02-3 (2H-Pyran-2-one-5-t,tetrahydro-5-t-4-hydroxy-4-methyl- (9CI))
125441-02-3 structure
Product Name:2H-Pyran-2-one-5-t,tetrahydro-5-t-4-hydroxy-4-methyl- (9CI)
CAS No:125441-02-3
MF:C6H10O3
MW:134.158020973206
CID:138464
PubChem ID:71308375
Update Time:2025-04-19
2H-Pyran-2-one-5-t,tetrahydro-5-t-4-hydroxy-4-methyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2H-Pyran-2-one-5-t,tetrahydro-5-t-4-hydroxy-4-methyl- (9CI)
- MEVALONOLACTONE, RS-, [5-3H]
- (+/-)-MEVALONOLACTONE-5-3H
- -]-MEVALONIC ACID LACTONE
- [+/-]-MEVALONIC ACID LACTONE
- DTXSID50745474
- 125441-02-3
- 4-Hydroxy-4-methyl(5,5-~3~H_2_)oxan-2-one
- 4-hydroxy-4-methyl-5,5-ditritiooxan-2-one
-
- Inchi： 1S/C6H10O3/c1-6(8)2-3-9-5(7)4-6/h8H,2-4H2,1H3/i2T2
- InChI Key： JYVXNLLUYHCIIH-BMCFWTDKSA-N
- SMILES： O1C(CC(C)(C([3H])([3H])C1)O)=O
Computed Properties
- Exact Mass: 134.079442676g/mol
- Monoisotopic Mass: 134.079442676g/mol
- Isotope Atom Count: 2
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 132
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 46.5?2
- Surface Charge: 0
- Tautomer Count: 2
- XLogP3: nothing
Experimental Properties
- Color/Form: liquid
- Flash Point: 16?°C
- PSA: 46.53000
- LogP: 0.07440
- Solubility: Not determined
2H-Pyran-2-one-5-t,tetrahydro-5-t-4-hydroxy-4-methyl- (9CI) Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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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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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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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
125441-02-3 (2H-Pyran-2-one-5-t,tetrahydro-5-t-4-hydroxy-4-methyl- (9CI)) Related Products
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