Cas no 487-74-1 ((1R,2S,7S,8R,9S)-3,3,7-Trimethyltricyclo[5.4.0.02,9]undecane-8-carboxylic acid)
![(1R,2S,7S,8R,9S)-3,3,7-Trimethyltricyclo[5.4.0.02,9]undecane-8-carboxylic acid structure](https://ossimg.kuujia.com/scimg/500/487-74-1x500.png)
487-74-1 structure
Product Name:(1R,2S,7S,8R,9S)-3,3,7-Trimethyltricyclo[5.4.0.02,9]undecane-8-carboxylic acid
CAS No:487-74-1
MF:C15H24O2
MW:236.349864959717
CID:2665888
Update Time:2023-08-06
(1R,2S,7S,8R,9S)-3,3,7-Trimethyltricyclo[5.4.0.02,9]undecane-8-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- (1S,3aα,8aα,9S)-Decahydro-4,8,8-trimethyl-1β,4β-methanoazulene-9-carboxylic acid
- isolongifolic acid
- (1R,2S,7S,8R,9S)-3,3,7-Trimethyltricyclo[5.4.0.02,9]undecane-8-carboxylic acid
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- Inchi： 1S/C15H24O2/c1-14(2)7-4-8-15(3)10-6-5-9(11(10)14)12(15)13(16)17/h9-12H,4-8H2,1-3H3,(H,16,17)/t9-,10+,11-,12-,15-/m0/s1
- InChI Key： KROJPNVXPGQHLH-ONQKKCPMSA-N
- SMILES： OC([C@@H]1[C@H]2CC[C@H]3[C@]1(C)CCCC(C)(C)[C@H]32)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 360
- Topological Polar Surface Area: 37.3
(1R,2S,7S,8R,9S)-3,3,7-Trimethyltricyclo[5.4.0.02,9]undecane-8-carboxylic acid Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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