Cas no 6553-81-7 (butyl cyclohexanecarboxylate)
butyl cyclohexanecarboxylate structure
Product Name:butyl cyclohexanecarboxylate
butyl cyclohexanecarboxylate Chemical and Physical Properties
Names and Identifiers
-
- butyl cyclohexanecarboxylate
- manganese(2+),3,5,5-trimethylhexanoate
- SCHEMBL453054
- Butyl cyclohexanecarboxylate #
- DTXSID30984127
- Cyclohexanecarboxylic acid butyl ester
- AKOS015967536
- Cyclohexanecarboxylic acid, butyl ester
- EINECS 229-475-4
- 4-TRANS-BUTYL CYCLOHEXANE CARBOXYLIC ACID
- AI3-33528
- NS00046964
- 6553-81-7
-
- Inchi： 1S/C11H20O2/c1-2-3-9-13-11(12)10-7-5-4-6-8-10/h10H,2-9H2,1H3
- InChI Key： IPGMIYAOWRJGBE-UHFFFAOYSA-N
- SMILES： O(CCCC)C(C1CCCCC1)=O
Computed Properties
- Exact Mass: 184.1464
- Monoisotopic Mass: 184.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 148
- 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: 3.4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
butyl cyclohexanecarboxylate Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
6553-81-7 (butyl cyclohexanecarboxylate) Related Products
- 4630-82-4(Methyl cyclohexanecarboxylate)
- 10032-15-2(Hexyl 2-methylbutanoate)
- 103-23-1(Bis(2-ethylhexyl)adipate)
- 13149-00-3((3aR,7aS)-rel-Hexahydro-1,3-isobenzofurandione)
- 7452-79-1(Ethyl 2-methylbutyrate)
- 94-60-0(Dimethyl Cyclohexane-1,4-dicarboxylate(1,4-Cyclohexanedicarboxylic Dimethyl Ester))
- 85-42-7(octahydro-2-benzofuran-1,3-dione)
- 14924-53-9(Ethyl cyclobutanecarboxylate)
- 1687-29-2(Dimethyl cis-1,2-Cyclohexanedicarboxylate)
- 1187-74-2(Acetonyl-succinic Acid Diethyl Ester)
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