Cas no 109956-89-0 (Cycloprop[e]indene-1a,2(1H)-dicarboxaldehyde,3a,4,5,6,6a,6b-hexahydro-5,5,6b-trimethyl-, (1aR,3aS,6aS,6bS)-)
109956-89-0 structure
Product Name:Cycloprop[e]indene-1a,2(1H)-dicarboxaldehyde,3a,4,5,6,6a,6b-hexahydro-5,5,6b-trimethyl-, (1aR,3aS,6aS,6bS)-
CAS No:109956-89-0
MF:C15H20O2
MW:232.318104743958
CID:181690
PubChem ID:163806
Update Time:2025-04-19
Cycloprop[e]indene-1a,2(1H)-dicarboxaldehyde,3a,4,5,6,6a,6b-hexahydro-5,5,6b-trimethyl-, (1aR,3aS,6aS,6bS)- Chemical and Physical Properties
Names and Identifiers
-
- Cycloprop[e]indene-1a,2(1H)-dicarboxaldehyde,3a,4,5,6,6a,6b-hexahydro-5,5,6b-trimethyl-, (1aR,3aS,6aS,6bS)-
- (1aR,3aS,6aS,6bS)-5,5,6b-Trimethyl-3a,4,5,6,6a,6b-hexahydrocyclop ropa[e]indene-1a,2(1H)-dicarbaldehyde
- Cycloprop[e]indene-1a,2(1H)-dicarboxaldehyde,3a,4,5,6,6a,6b-hexahydro-5,5,6b-trimethyl-, (1aR,...
- ISO-ISOVELLERAL
- (1-Acetoxy-cyclohexyl)-phenyl-keton
- < 1-Acetoxy-cyclohexyl> -phenyl-keton
- 1-benzoylcyclohexyl acetate
- 1-Benzoyl-cyclohexylacetat
- AC1L80ZE
- Isovelleral
- NSC401647
- (1aR)-3aβ,4,5,6,6aβ,6b-Hexahydro-5,5,6bβ-trimethylcycloprop[e]indene-1aβ,2(1H)-dicarbaldehyde
- (1aR,3aS,6aS,6bS)-5,5,6b-trimethyl-3a,4,6,6a-tetrahydro-1H-cyclopropa[e]indene-1a,2-dicarbaldehyde
- 109956-89-0
- 5,5,6b-Trimethyl-3a,4,5,6,6a,6b-hexahydrocyclopropa[e]indene-1a,2(1H)-dicarbaldehyde
- Cycloprop[e]indene-1a,2(1H)-dicarboxaldehyde, 3a,4,5,6,6a,6b-hexahydro-5,5,6b-trimethyl-, (1aR,3aS,6aS,6bS)-
- CCRIS 5097
- DTXSID80911408
-
- Inchi: 1S/C15H20O2/c1-13(2)5-10-4-11(7-16)15(9-17)8-14(15,3)12(10)6-13/h4,7,9-10,12H,5-6,8H2,1-3H3/t10-,12+,14+,15+/m1/s1
- InChI Key: PJAAESPGJOSQGZ-WCUVEOEZSA-N
- SMILES: O=C[C@@]12C(C=O)=C[C@@H]3CC(C)(C)C[C@@H]3[C@]1(C)C2
Computed Properties
- Exact Mass: 232.146
- Monoisotopic Mass: 232.146
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 434
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- Density: 1.211
- Boiling Point: 322.8°Cat760mmHg
- Flash Point: 120.9°C
- Refractive Index: 1.637
- PSA: 34.14000
- LogP: 2.77300
Cycloprop[e]indene-1a,2(1H)-dicarboxaldehyde,3a,4,5,6,6a,6b-hexahydro-5,5,6b-trimethyl-, (1aR,3aS,6aS,6bS)- Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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5. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
109956-89-0 (Cycloprop[e]indene-1a,2(1H)-dicarboxaldehyde,3a,4,5,6,6a,6b-hexahydro-5,5,6b-trimethyl-, (1aR,3aS,6aS,6bS)-) Related Products
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