Cas no 18731-59-4 (Cyclohexanecarboxylicacid, 3-methylphenyl ester)
18731-59-4 structure
Product Name:Cyclohexanecarboxylicacid, 3-methylphenyl ester
CAS No:18731-59-4
MF:C14H18O2
MW:218.291524410248
CID:163638
PubChem ID:87766
Update Time:2025-04-19
Cyclohexanecarboxylicacid, 3-methylphenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarboxylicacid, 3-methylphenyl ester
- 3-methylphenyl cyclohexanecarboxylate
- (3-methylphenyl) cyclohexanecarboxylate
- Einecs 242-542-2
- Cyclohexanecarboxylic acid 3-methylphenyl ester
- WSOGYYKXYMIDJU-UHFFFAOYSA-N
- m-cresyl cyclohex-anecarboxylate
- m-Tolyl cyclohexanecarboxylate
- 18731-59-4
- (3-Methylphenyl)cyclohexanecarboxylate
- DTXSID70172041
- Cyclohexanecarboxylic acid, m-tolyl ester
- NS00026122
- Cyclohexanecarboxylic acid, 3-methylphenyl ester
- AF7PP7CPM4
-
- Inchi： 1S/C14H18O2/c1-11-6-5-9-13(10-11)16-14(15)12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3
- InChI Key： WSOGYYKXYMIDJU-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C(C)C=1)C(C1CCCCC1)=O
Computed Properties
- Exact Mass: 218.13074
- Monoisotopic Mass: 218.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 231
- 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: 4.2
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
Cyclohexanecarboxylicacid, 3-methylphenyl ester Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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