Cas no 93892-34-3 (6-isobutyl-1,1,3,3-tetramethylindan-5-ol)
93892-34-3 structure
Product Name:6-isobutyl-1,1,3,3-tetramethylindan-5-ol
CAS No:93892-34-3
MF:C17H26O
MW:246.387745380402
CID:1000299
PubChem ID:3022770
Update Time:2025-04-20
6-isobutyl-1,1,3,3-tetramethylindan-5-ol Chemical and Physical Properties
Names and Identifiers
-
- 6-isobutyl-1,1,3,3-tetramethylindan-5-ol
- 1,1,3,3-tetramethyl-6-(2-methylpropyl)-2H-inden-5-ol
- 2DL3VHF3DA
- 93892-34-3
- 2,3-Dihydro-1,1,3,3-tetramethyl-6-(2-methylpropyl)-1H-inden-5-ol
- DTXSID20239835
- 1H-Inden-5-ol, 2,3-dihydro-1,1,3,3-tetramethyl-6-(2-methylpropyl)-
- NS00039727
- EINECS 299-516-9
- NZXCKXLASHGCFV-UHFFFAOYSA-N
-
- Inchi： 1S/C17H26O/c1-11(2)7-12-8-13-14(9-15(12)18)17(5,6)10-16(13,3)4/h8-9,11,18H,7,10H2,1-6H3
- InChI Key： NZXCKXLASHGCFV-UHFFFAOYSA-N
- SMILES： OC1C(CC(C)C)=CC2=C(C=1)C(C)(C)CC2(C)C
Computed Properties
- Exact Mass: 246.198
- Monoisotopic Mass: 246.198
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 303
- 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: 5.7
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Density: 0.947
- Boiling Point: 328.8°C at 760 mmHg
- Flash Point: 148.1°C
- Refractive Index: 1.509
6-isobutyl-1,1,3,3-tetramethylindan-5-ol Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
93892-34-3 (6-isobutyl-1,1,3,3-tetramethylindan-5-ol) Related Products
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