Cas no 18444-94-5 ((3aS)-3c,7,7-Trimethyl-8-methylen-(8ac)-octahydro-3ar,6-methano-azulen)
18444-94-5 structure
Product Name:(3aS)-3c,7,7-Trimethyl-8-methylen-(8ac)-octahydro-3ar,6-methano-azulen
CAS No:18444-94-5
MF:C15H24
MW:204.351064682007
CID:2034115
PubChem ID:12304853
Update Time:2025-04-21
(3aS)-3c,7,7-Trimethyl-8-methylen-(8ac)-octahydro-3ar,6-methano-azulen Chemical and Physical Properties
Names and Identifiers
-
- (3aS)-3c,7,7-Trimethyl-8-methylen-(8ac)-octahydro-3ar,6-methano-azulen
- (3aS)-3c,7,7-trimethyl-8-methylen-(8ac)-octahydro-3ar,6-methano-azulene
- 6(13)-Zizaene
- Tricycloretiven, Zizaen
- tricyclovetivene
- Zizaen(Tricyclovetiven)
- zizaene
- (3S)-2,3,4,5,6,7,8,8aα-Octahydro-3,7,7-trimethyl-8-methylene-1H-3aα,6α-methanoazulene
- Khusene
- Khusimene
- (3S)-2,3,4,5,6,7,8,8aalpha-Octahydro-3,7,7-trimethyl-8-methylene-1H-3aalpha,6alpha-methanoazulene
- VBZRHXLPRWBPEH-ZGFBFQLVSA-N
- 18444-94-5
- (3S,3aS,6R,8aS)-3,7,7-Trimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene
- (1S,2S,5S,8R)-2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane
-
- Inchi： 1S/C15H24/c1-10-5-6-13-11(2)14(3,4)12-7-8-15(10,13)9-12/h10,12-13H,2,5-9H2,1,3-4H3/t10-,12+,13+,15-/m0/s1
- InChI Key： VBZRHXLPRWBPEH-ZGFBFQLVSA-N
- SMILES： [C@]123CC[C@@H](C(C)(C)C(=C)[C@H]1CC[C@@H]2C)C3
Computed Properties
- Exact Mass: 204.187800766g/mol
- Monoisotopic Mass: 204.187800766g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 312
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.444
- Topological Polar Surface Area: 0?2
(3aS)-3c,7,7-Trimethyl-8-methylen-(8ac)-octahydro-3ar,6-methano-azulen Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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