Cas no 86951-91-9 ([S,(-)]-3,7-Dimethyl-7-octenal)
![[S,(-)]-3,7-Dimethyl-7-octenal structure](https://ossimg.kuujia.com/scimg/87000/86951-91-9x500.png)
86951-91-9 structure
Product Name:[S,(-)]-3,7-Dimethyl-7-octenal
CAS No:86951-91-9
MF:C10H18O
MW:154.249323368073
CID:1859392
PubChem ID:72941617
Update Time:2024-03-01
[S,(-)]-3,7-Dimethyl-7-octenal Chemical and Physical Properties
Names and Identifiers
-
- [S,(-)]-3,7-Dimethyl-7-octenal
- .ALPHA.-CITRONELLAL, (S)-
- UNII-5HVH2U9418
- Q27262222
- 5HVH2U9418
- (S)-alpha-Citronellal
- (S)-.ALPHA.-CITRONELLAL
- 7-Octenal, 3,7-dimethyl-, (3S)-
- 86951-91-9
- alpha-Citronellal, (S)-
-
- Inchi： 1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h8,10H,1,4-7H2,2-3H3/t10-/m0/s1
- InChI Key： KQZAHMIZMBERJX-JTQLQIEISA-N
- SMILES： O=CC[C@@H](C)CCCC(=C)C
Computed Properties
- Exact Mass: 154.135765193g/mol
- Monoisotopic Mass: 154.135765193g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 127
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.3
- Topological Polar Surface Area: 17.1?2
[S,(-)]-3,7-Dimethyl-7-octenal Related Literature
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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3. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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