Cas no 5258-11-7 ((-)-TRANS-ROSE OXIDE)
(-)-TRANS-ROSE OXIDE structure
Product Name:(-)-TRANS-ROSE OXIDE
CAS No:5258-11-7
MF:C10H18O
MW:154.249323368073
CID:937143
PubChem ID:7093102
Update Time:2025-04-19
(-)-TRANS-ROSE OXIDE Chemical and Physical Properties
Names and Identifiers
-
- (-)-TRANS-ROSE OXIDE
- 2H-Pyran, tetrahydro-4-methyl-2-(2-methyl-1-propenyl)-, trans-
- (4R,2R)-(-)-Rose oxide
- Q27162311
- (+-)-trans-Rose oxide
- trans-Rose oxide
- CHEBI:90100
- UNII-B19Q1KY4EC
- (2R,4R)-rose oxide
- 2H-Pyran, tetrahydro-4-methyl-2-(2-methylpropenyl)-, trans-
- (t)-Rose oxide
- 5258-11-7
- 2H-Pyran, tetrahydro-4-methyl-2-(2-methyl-1-propenyl)-, (2R-trans)-
- SCHEMBL309437
- 876-18-6
- CZCBTSFUTPZVKJ-ZJUUUORDSA-N
- FEMA No. 3236, trans-(+-)-
- ROSE OXIDE, TRANS-(+/-)-
- AKOS024287126
- Rose oxide, trans-(-)-
- XF860DJU9P
- (2R,4R)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran
- 2H-Pyran, tetrahydro-4-methyl-2-(2-methyl-1-propenyl)-, (2R,4R)-rel-
- (2R,4R)-4-methyl-2-(2-methylprop-1-enyl)oxane
- UNII-XF860DJU9P
- ROSE OXIDE, TRANS-
- DTXSID601017545
- Trans-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran
- FEMA No. 3236, trans-(-)-
- trans-(-)-Rose oxide
- (2R,4R)-(-)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran
- 2H-Pyran, tetrahydro-4-methyl-2-(2-methyl-1-propen-1-yl)-, (2R,4R)-
- 2H-Pyran, tetrahydro-4-methyl-2-(2-methyl-1-propenyl)-, (2R,4R)-
- (E)-Rose oxide
- (+/-)-TRANS-ROSE OXIDE
- (-)-(2R,4R)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran
- FEMA NO. 3236, TRANS-(+/-)-
- 4-Methyl-2-(2-methyl-1-propenyl)tetrahydro-2H-pyran #
- Rose oxide, II
- Rose oxide II
- Rose oxide, trans-(+-)-
- (-)-Rose oxide
- B19Q1KY4EC
-
- Inchi: 1S/C10H18O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,9-10H,4-5,7H2,1-3H3/t9-,10+/m1/s1
- InChI Key: CZCBTSFUTPZVKJ-ZJUUUORDSA-N
- SMILES: O1CC[C@@H](C)C[C@@H]1/C=C(\C)/C
Computed Properties
- Exact Mass: 154.13584
- 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: 1
- Complexity: 145
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- Boiling Point: 75-76?°C/12?mmHg(lit.)
- Flash Point: 68?°C
- PSA: 9.23
(-)-TRANS-ROSE OXIDE Related Literature
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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