Cas no 62797-47-1 (Cyclohexene, 1-methyl-4-(1-propenyl)-, (S)-)
62797-47-1 structure
Product Name:Cyclohexene, 1-methyl-4-(1-propenyl)-, (S)-
CAS No:62797-47-1
MF:C10H16
MW:136.234043121338
CID:431040
PubChem ID:71382688
Update Time:2025-04-19
Cyclohexene, 1-methyl-4-(1-propenyl)-, (S)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexene, 1-methyl-4-(1-propenyl)-, (S)-
- (4S)-1-methyl-4-prop-1-enylcyclohexene
- 62797-47-1
- (4S)-1-Methyl-4-(prop-1-en-1-yl)cyclohex-1-ene
- DTXSID30805065
-
- Inchi： 1S/C10H16/c1-3-4-10-7-5-9(2)6-8-10/h3-5,10H,6-8H2,1-2H3/t10-/m1/s1
- InChI Key： YTTNUNRNRDQUKQ-SNVBAGLBSA-N
- SMILES： [C@@H]1(C=CC)CC=C(C)CC1
Computed Properties
- Exact Mass: 136.12528
- Monoisotopic Mass: 136.125200510g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 151
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 3
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Cyclohexene, 1-methyl-4-(1-propenyl)-, (S)- Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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