Cas no 933782-13-9 (Ethyl 2-cycloheptyl-4-methyloxazole-5-carboxylate)
933782-13-9 structure
Product Name:Ethyl 2-cycloheptyl-4-methyloxazole-5-carboxylate
CAS No:933782-13-9
MF:C14H21NO3
MW:251.321444272995
CID:2116127
Update Time:2023-08-04
Ethyl 2-cycloheptyl-4-methyloxazole-5-carboxylate Chemical and Physical Properties
Names and Identifiers
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- ethyl 2-cycloheptyl-4-methyloxazole-5-carboxylate
- Ethyl 2-cycloheptyl-4-methyloxazole-5-carboxylate
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- Inchi： 1S/C14H21NO3/c1-3-17-14(16)12-10(2)15-13(18-12)11-8-6-4-5-7-9-11/h11H,3-9H2,1-2H3
- InChI Key： PDGWCALBMNORRP-UHFFFAOYSA-N
- SMILES： O1C(C(=O)OCC)=C(C)N=C1C1CCCCCC1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 274
- Topological Polar Surface Area: 52.3
Ethyl 2-cycloheptyl-4-methyloxazole-5-carboxylate Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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