Cas no 88862-14-0 ((1R)-1,4,4aβ,5,6,7,8,8a-Octahydro-2,5,5,8aα-tetramethylnaphthalene-1α-acetaldehyde)
88862-14-0 structure
Product Name:(1R)-1,4,4aβ,5,6,7,8,8a-Octahydro-2,5,5,8aα-tetramethylnaphthalene-1α-acetaldehyde
CAS No:88862-14-0
MF:C16H26O
MW:234.377045154572
CID:1933275
Update Time:2024-03-01
(1R)-1,4,4aβ,5,6,7,8,8a-Octahydro-2,5,5,8aα-tetramethylnaphthalene-1α-acetaldehyde Chemical and Physical Properties
Names and Identifiers
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- (1R)-1,4,4aβ,5,6,7,8,8a-Octahydro-2,5,5,8aα-tetramethylnaphthalene-1α-acetaldehyde
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- Inchi： 1S/C16H26O/c1-12-6-7-14-15(2,3)9-5-10-16(14,4)13(12)8-11-17/h6,11,13-14H,5,7-10H2,1-4H3/t13-,14-,16+/m1/s1
- InChI Key： SZWZLWGBWZARPP-FMKPAKJESA-N
- SMILES： C(=O)C[C@H]1[C@@]2(C)[C@@]([H])(C(C)(C)CCC2)CC=C1C
Computed Properties
- Exact Mass: 234.198
- Monoisotopic Mass: 234.198
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 339
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 17.1A^2
- XLogP3: 6.107
(1R)-1,4,4aβ,5,6,7,8,8a-Octahydro-2,5,5,8aα-tetramethylnaphthalene-1α-acetaldehyde Related Literature
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Connor J. Taylor,Hikaru Seki,Friederike M. Dannheim,Mark J. Willis,Graeme Clemens,Brian A. Taylor,Thomas W. Chamberlain,Richard A. Bourne React. Chem. Eng., 2021,6, 1404-1411
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4. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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