Cas no 30779-95-4 (1,9-Heptadecadiene-4,6-diyne-3,8-diol)
30779-95-4 structure
Product Name:1,9-Heptadecadiene-4,6-diyne-3,8-diol
CAS No:30779-95-4
MF:C17H24O2
MW:260.371265411377
CID:322617
PubChem ID:5283263
Update Time:2025-04-19
1,9-Heptadecadiene-4,6-diyne-3,8-diol Chemical and Physical Properties
Names and Identifiers
-
- 1,9-Heptadecadiene-4,6-diyne-3,8-diol
- 1,9-Heptadecadiene-4,6-diyne-3,8-diol, (3S,8S,9Z)-
- Falcarindiol
- 727380-04-3
- (9E)-heptadeca-1,9-dien-4,6-diyne-3,8-diol
- SCHEMBL40936
- 30779-95-4
- (E)-Heptadeca-1,9-dien-4,6-diyne-3,8-diol
- 55297-87-5
- AKOS016009675
- heptadeca-1,9-dien-4,6-diyne-3,8-diol
-
- Inchi： 1S/C17H24O2/c1-3-5-6-7-8-9-10-14-17(19)15-12-11-13-16(18)4-2/h4,10,14,16-19H,2-3,5-9H2,1H3/b14-10+
- InChI Key： QWCNQXNAFCBLLV-GXDHUFHOSA-N
- SMILES： OC(C#CC#CC(C=C)O)/C=C/CCCCCCC
Computed Properties
- Exact Mass: 260.17772
- Monoisotopic Mass: 260.17763
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 9
- Complexity: 394
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.5
- XLogP3: 4.4
Experimental Properties
- Density: 1
- Boiling Point: 408.2°Cat760mmHg
- Flash Point: 184.7°C
- PSA: 40.46
1,9-Heptadecadiene-4,6-diyne-3,8-diol Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
30779-95-4 (1,9-Heptadecadiene-4,6-diyne-3,8-diol) Related Products
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