Cas no 132970-76-4 ((1R,2S,3aR,4R,5S,7aR)-3a,4,5-trimethyl-1-(prop-1-en-2-yl)octahydro-1H-indene-2,5-diol)
132970-76-4 structure
Product Name:(1R,2S,3aR,4R,5S,7aR)-3a,4,5-trimethyl-1-(prop-1-en-2-yl)octahydro-1H-indene-2,5-diol
CAS No:132970-76-4
MF:C15H26O2
MW:238.365745067596
CID:1231424
PubChem ID:183116
Update Time:2025-04-20
(1R,2S,3aR,4R,5S,7aR)-3a,4,5-trimethyl-1-(prop-1-en-2-yl)octahydro-1H-indene-2,5-diol Chemical and Physical Properties
Names and Identifiers
-
- (1R,2S,3aR,4R,5S,7aR)-3a,4,5-trimethyl-1-(prop-1-en-2-yl)octahydro-1H-indene-2,5-diol
- (1R,2S,3aR,4R,5S,7aR)-3a,4,5-trimethyl-1-prop-1-en-2-yl-2,3,4,6,7,7a-hexahydro-1H-indene-2,5-diol
- Seiricardine A
- CHEBI:9084
- (1R,2S,3aR,4R,5S,7aR)-1-isopropenyl-3a,4,5-trimethyl-2,3,4,6,7,7a-hexahydro-1H-indene-2,5-diol
- 132970-76-4
- 1H-Indene-2,5-diol, octahydro-3a,4,5-trimethyl-1-(1-methylethenyl)-, (1alpha,2beta,3aalpha,4beta,5beta,7abeta)-(-)-
- C09722
- DTXSID40927883
- Q27108265
- AC1L4C9Q
- Seiricardin A
- 3a,4,5-Trimethyl-1-(prop-1-en-2-yl)octahydro-1H-indene-2,5-diol
-
- Inchi： 1S/C15H26O2/c1-9(2)13-11-6-7-15(5,17)10(3)14(11,4)8-12(13)16/h10-13,16-17H,1,6-8H2,2-5H3/t10-,11-,12+,13+,14+,15+/m1/s1
- InChI Key： CGKHVNUMMHTZJY-UMBPPFEGSA-N
- SMILES： O[C@@]1(C)CC[C@@H]2[C@H](C(=C)C)[C@H](C[C@@]2(C)[C@H]1C)O
Computed Properties
- Exact Mass: 238.193280068g/mol
- Monoisotopic Mass: 238.193280068g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 338
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 6
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 40.5?2
(1R,2S,3aR,4R,5S,7aR)-3a,4,5-trimethyl-1-(prop-1-en-2-yl)octahydro-1H-indene-2,5-diol Related Literature
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
132970-76-4 ((1R,2S,3aR,4R,5S,7aR)-3a,4,5-trimethyl-1-(prop-1-en-2-yl)octahydro-1H-indene-2,5-diol) Related Products
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