Cas no 16070-12-5 (Dodecanoic acid,2-(diethylamino)ethyl ester)
16070-12-5 structure
Product Name:Dodecanoic acid,2-(diethylamino)ethyl ester
CAS No:16070-12-5
MF:C18H37NO2
MW:299.491885900497
CID:190388
PubChem ID:85269
Update Time:2025-04-19
Dodecanoic acid,2-(diethylamino)ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Dodecanoic acid,2-(diethylamino)ethyl ester
- 2-(diethylamino)ethyl dodecanoate
- 2-(diethylamino)ethyl laurate
- SCHEMBL4245473
- 2-Di-Ethylaminoethyl Dodecanoate
- C4FV47YR2S
- Dodecanoic acid, 2-(diethylamino)ethyl ester
- DTXSID00166973
- NS00025236
- 16070-12-5
- CHEMBL1275765
- EINECS 240-218-5
-
- Inchi: 1S/C18H37NO2/c1-4-7-8-9-10-11-12-13-14-15-18(20)21-17-16-19(5-2)6-3/h4-17H2,1-3H3
- InChI Key: UNWMSJSGBWRHNY-UHFFFAOYSA-N
- SMILES: O(CCN(CC)CC)C(CCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 299.28261
- Monoisotopic Mass: 299.282
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 16
- Complexity: 227
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 29.5A^2
- XLogP3: 6
Experimental Properties
- Density: 0.89
- Boiling Point: 375.9°Cat760mmHg
- Flash Point: 101.1°C
- Refractive Index: 1.453
- PSA: 29.54
Dodecanoic acid,2-(diethylamino)ethyl ester Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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