Cas no 69868-05-9 (Nonadecanoic acid,2-ethyl-)
Nonadecanoic acid,2-ethyl- structure
Product Name:Nonadecanoic acid,2-ethyl-
CAS No:69868-05-9
MF:C21H42O2
MW:326.556987285614
CID:504534
PubChem ID:112164
Update Time:2025-04-19
Nonadecanoic acid,2-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- Nonadecanoic acid,2-ethyl-
- 2-ethylnonadecan-1-oic acid
- 2-ethylnonadecanoic acid
- Nonadecanoic acid, 2-ethyl-
- SCHEMBL5878966
- EINECS 274-167-5
- 69868-05-9
- NS00063103
- DTXSID80887679
-
- Inchi: 1S/C21H42O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(4-2)21(22)23/h20H,3-19H2,1-2H3,(H,22,23)
- InChI Key: SEVBTWRNJDEVHQ-UHFFFAOYSA-N
- SMILES: OC(C(CC)CCCCCCCCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 326.31866
- Monoisotopic Mass: 326.318
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 23
- Rotatable Bond Count: 18
- Complexity: 250
- 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
- XLogP3: 9.7
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- Density: 0.882
- Boiling Point: 443.2°C at 760 mmHg
- Flash Point: 251.2°C
- Refractive Index: 1.457
- PSA: 37.3
Nonadecanoic acid,2-ethyl- Related Literature
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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