Cas no 10369-82-1 (Acetic acid,2-(diethylamino)ethyl ester)
10369-82-1 structure
Product Name:Acetic acid,2-(diethylamino)ethyl ester
Acetic acid,2-(diethylamino)ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid,2-(diethylamino)ethyl ester
- 2-(diethylamino)ethyl acetate
- Q63408810
- Acetylcaine
- acetic acid diethylaminoethyl ester
- DTXSID00146013
- NSC 408333
- AI3-05553
- NSC-408333
- EINECS 233-811-5
- NS00023255
- SCHEMBL454947
- Acetic acid, 2-(diethylamino)ethyl ester
- 2-diethylaminoethyl acetate
- IDIFJUBLWASPDU-UHFFFAOYSA-N
- 10369-82-1
- NSC408333
- N,N-Diethyl-2-aminoethanol, O-acetyl
-
- Inchi： 1S/C8H17NO2/c1-4-9(5-2)6-7-11-8(3)10/h4-7H2,1-3H3
- InChI Key： IDIFJUBLWASPDU-UHFFFAOYSA-N
- SMILES： O(C(C)=O)CCN(CC)CC
Computed Properties
- Exact Mass: 159.12601
- Monoisotopic Mass: 159.126
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 111
- 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: 0.9
Experimental Properties
- Density: 0.929
- Boiling Point: 199.4°Cat760mmHg
- Flash Point: 68.6°C
- Refractive Index: 1.433
- PSA: 29.54
- LogP: 0.89130
Acetic acid,2-(diethylamino)ethyl ester Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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