Cas no 118610-60-9 (3-benzoFuranacetic acid, 5-methoxy-, methyl ester)
118610-60-9 structure
Product Name:3-benzoFuranacetic acid, 5-methoxy-, methyl ester
CAS No:118610-60-9
MF:C12H12O4
MW:220.221283912659
CID:1100901
PubChem ID:14982872
Update Time:2025-04-20
3-benzoFuranacetic acid, 5-methoxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-benzoFuranacetic acid, 5-methoxy-, methyl ester
- methyl 2-(5-methoxybenzofuran-3-yl)acetate
- DB-351780
- methyl 2-(5-methoxy-1-benzofuran-3-yl)acetate
- 118610-60-9
-
- Inchi： 1S/C12H12O4/c1-14-9-3-4-11-10(6-9)8(7-16-11)5-12(13)15-2/h3-4,6-7H,5H2,1-2H3
- InChI Key： BFKFTCAHLXGCDQ-UHFFFAOYSA-N
- SMILES： O1C=C(CC(=O)OC)C2C=C(C=CC1=2)OC
Computed Properties
- Exact Mass: 220.07355886g/mol
- Monoisotopic Mass: 220.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 253
- 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: 48.7?2
3-benzoFuranacetic acid, 5-methoxy-, methyl ester Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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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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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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