Cas no 1002-64-8 (2,8-Decadiene-4,6-diyn-1-ol, acetate, (E,E)-)
1002-64-8 structure
Product Name:2,8-Decadiene-4,6-diyn-1-ol, acetate, (E,E)-
CAS No:1002-64-8
MF:C12H12O2
MW:188.222483634949
CID:1125237
PubChem ID:13845788
Update Time:2025-04-20
2,8-Decadiene-4,6-diyn-1-ol, acetate, (E,E)- Chemical and Physical Properties
Names and Identifiers
-
- 2,8-Decadiene-4,6-diyn-1-ol, acetate, (E,E)-
- (2E,8E)-2,8-Decadiene-4,6-diyn-1-ol acetate
- acetic acid,deca-2,8-dien-4,6-diyn-1-ol
- [(2E,8E)-deca-2,8-dien-4,6-diynyl] acetate
- 1002-64-8
- (2E,8E)-DECA-2,8-DIEN-4,6-DIYN-1-YL ACETATE
-
- Inchi： 1S/C12H12O2/c1-3-4-5-6-7-8-9-10-11-14-12(2)13/h3-4,9-10H,11H2,1-2H3/b4-3+,10-9+
- InChI Key： UMCLGRSXAWVDFB-SCPMJEMWSA-N
- SMILES： O(C(C)=O)C/C=C/C#CC#C/C=C/C
Computed Properties
- Exact Mass: 188.083729621g/mol
- Monoisotopic Mass: 188.083729621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 360
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 26.3?2
2,8-Decadiene-4,6-diyn-1-ol, acetate, (E,E)- Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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