Cas no 6059-86-5 (methyl 2-O-benzoylpentopyranoside)
6059-86-5 structure
Product Name:methyl 2-O-benzoylpentopyranoside
CAS No:6059-86-5
MF:C13H16O6
MW:268.262544631958
CID:2626782
PubChem ID:251456
Update Time:2025-04-21
methyl 2-O-benzoylpentopyranoside Chemical and Physical Properties
Names and Identifiers
-
- methyl 2-O-benzoylpentopyranoside
- 6059-86-5
- NSC-71848
- DTXSID60976030
- NSC71848
-
- Inchi： 1S/C13H16O6/c1-17-13-11(10(15)9(14)7-18-13)19-12(16)8-5-3-2-4-6-8/h2-6,9-11,13-15H,7H2,1H3
- InChI Key： PURQWSJCMBHADD-UHFFFAOYSA-N
- SMILES： O1CC(C(C(C1OC)OC(C1C=CC=CC=1)=O)O)O
Computed Properties
- Exact Mass: 268.09468823Da
- Monoisotopic Mass: 268.09468823Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 302
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.2
- Topological Polar Surface Area: 85.2?2
methyl 2-O-benzoylpentopyranoside Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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