Cas no 29463-45-4 (Myrcene)
Myrcene structure
Product Name:Myrcene
CAS No:29463-45-4
MF:C10H16
MW:136.2340
CID:5083018
Update Time:2022-06-06
Myrcene Chemical and Physical Properties
Names and Identifiers
-
- MYRCENE
- beta-Myrcene
- 7-Methyl-3-methyleneocta-1,6-diene
- 7-Methyl-3-methylene-1,6-octadiene
- 1,6-Octadiene, 7-methyl-3-methylene-
- 7-methyl-3-methylideneocta-1,6-diene
- .beta.-Myrcene
- 2-Methyl-6-methylene-2,7-octadiene
- beta-geraniolene
- b-Myrcene
- 3-Methylene-7-methyl-1,6-octadiene
- FEMA No. 2762
- .beta.-Geraniolene
- 7-Methyl-3-methylene-octa-1,6-diene
- 3M39CZS25B
- Myrcene (stabilized with BHT)
- 7-Methyl-3-methyleneoctadiene-(1,6)
- Myrce
- Myrcene
-
- Inchi: 1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3
- InChI Key: UAHWPYUMFXYFJY-UHFFFAOYSA-N
- SMILES: C([H])([H])(/C(/[H])=C(\C([H])([H])[H])/C([H])([H])[H])C([H])([H])C(=C([H])[H])C([H])=C([H])[H]
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 145
- XLogP3: 4.3
- Topological Polar Surface Area: 0
Myrcene Related Literature
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
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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