Cas no 35329-42-1 (1-Undecen-3-ol)
1-Undecen-3-ol structure
Product Name:1-Undecen-3-ol
CAS No:35329-42-1
MF:C11H22O
MW:170.291783809662
CID:316056
PubChem ID:3015762
Update Time:2025-04-19
1-Undecen-3-ol Chemical and Physical Properties
Names and Identifiers
-
- 1-Undecen-3-ol
- undec-1-en-3-ol
- DTXSID10956761
- NS00057593
- LMFA05000513
- EINECS 252-515-7
- A822738
- NAOMHUDQUVEWEF-UHFFFAOYSA-N
- AKOS006327948
- 35329-42-1
- SCHEMBL2529542
-
- Inchi： 1S/C11H22O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,11-12H,2-3,5-10H2,1H3
- InChI Key： NAOMHUDQUVEWEF-UHFFFAOYSA-N
- SMILES： OC(C=C)CCCCCCCC
Computed Properties
- Exact Mass: 170.16716
- Monoisotopic Mass: 170.167
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 8
- Complexity: 99.2
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 20.2A^2
- XLogP3: 4.2
Experimental Properties
- Density: 0.838
- Boiling Point: 229 oC
- Flash Point: 89 oC
- Refractive Index: 1.446
- PSA: 20.23
- LogP: 3.28390
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