Cas no 89393-78-2 (4-Cyclohexene-1,2-dicarboxylic acid, cyclohexyl oxiranylmethyl ester)
89393-78-2 structure
Product Name:4-Cyclohexene-1,2-dicarboxylic acid, cyclohexyl oxiranylmethyl ester
CAS No:89393-78-2
MF:C17H24O5
MW:308.369465827942
CID:602256
PubChem ID:13209909
Update Time:2025-04-19
4-Cyclohexene-1,2-dicarboxylic acid, cyclohexyl oxiranylmethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 4-Cyclohexene-1,2-dicarboxylic acid, cyclohexyl oxiranylmethyl ester
- 2-O-cyclohexyl 1-O-(oxiran-2-ylmethyl) cyclohex-4-ene-1,2-dicarboxylate
- DTXSID90528006
- 89393-78-2
- Cyclohexyl (oxiran-2-yl)methyl cyclohex-4-ene-1,2-dicarboxylate
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- Inchi： 1S/C17H24O5/c18-16(21-11-13-10-20-13)14-8-4-5-9-15(14)17(19)22-12-6-2-1-3-7-12/h4-5,12-15H,1-3,6-11H2
- InChI Key： HXLDHIHPWKBOOS-UHFFFAOYSA-N
- SMILES： O(C(C1CC=CCC1C(=O)OCC1CO1)=O)C1CCCCC1
Computed Properties
- Exact Mass: 308.16237386g/mol
- Monoisotopic Mass: 308.16237386g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 7
- Complexity: 438
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.6
- Topological Polar Surface Area: 65.1?2
4-Cyclohexene-1,2-dicarboxylic acid, cyclohexyl oxiranylmethyl ester Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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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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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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