Cas no 101491-62-7 (Carbamic acid,[2-(diethylamino)ethyl]-, (2,6-dimethylphenyl)methyl ester, monohydrochloride(9CI))
![Carbamic acid,[2-(diethylamino)ethyl]-, (2,6-dimethylphenyl)methyl ester, monohydrochloride(9CI) structure](https://ossimg.kuujia.com/scimg/101500/101491-62-7x500.png)
101491-62-7 structure
Product Name:Carbamic acid,[2-(diethylamino)ethyl]-, (2,6-dimethylphenyl)methyl ester, monohydrochloride(9CI)
CAS No:101491-62-7
MF:C16H27ClN2O2
MW:314.850783586502
CID:159737
PubChem ID:58435
Update Time:2025-04-19
Carbamic acid,[2-(diethylamino)ethyl]-, (2,6-dimethylphenyl)methyl ester, monohydrochloride(9CI) Chemical and Physical Properties
Names and Identifiers
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- Carbamic acid,[2-(diethylamino)ethyl]-, (2,6-dimethylphenyl)methyl ester, monohydrochloride(9CI)
- Carbamicacid, (2-diethylaminoethyl)-, 2,6-dimethylbenzyl ester, hydrochloride (6CI)
- 2-[(2,6-dimethylphenyl)methoxycarbonylamino]ethyl-diethylazanium,chloride
- Carbamic acid, (2-(diethylamino)ethyl)-, 2,6-dimethylbenzyl ester, monohydrochloride
- 2,6-Dimethylbenzyl N-(2-(diethylamino)ethyl)carbamate hydrochloride
- 101491-62-7
-
- Inchi： 1S/C16H26N2O2.ClH/c1-5-18(6-2)11-10-17-16(19)20-12-15-13(3)8-7-9-14(15)4;/h7-9H,5-6,10-12H2,1-4H3,(H,17,19);1H
- InChI Key： NCFCFEHMMIUPBF-UHFFFAOYSA-N
- SMILES： [Cl-].O(CC1C(C)=CC=CC=1C)C(NCC[NH+](CC)CC)=O
Computed Properties
- Exact Mass: 286.9649
- Monoisotopic Mass: 314.1761058g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 8
- Complexity: 270
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 42.8?2
Experimental Properties
- PSA: 46.3
Carbamic acid,[2-(diethylamino)ethyl]-, (2,6-dimethylphenyl)methyl ester, monohydrochloride(9CI) Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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