Cas no 62620-28-4 (Morpholinium, 3-(carboxymethylene)-4,4-diethyl-, bromide)
62620-28-4 structure
Product Name:Morpholinium, 3-(carboxymethylene)-4,4-diethyl-, bromide
CAS No:62620-28-4
MF:C10H18BrNO3
MW:280.158822536469
CID:437758
PubChem ID:71384485
Update Time:2025-04-19
Morpholinium, 3-(carboxymethylene)-4,4-diethyl-, bromide Chemical and Physical Properties
Names and Identifiers
-
- Morpholinium, 3-(carboxymethylene)-4,4-diethyl-, bromide
- 2-(4,4-diethylmorpholin-4-ium-3-ylidene)acetic acid,bromide
- DTXSID30806739
- 62620-28-4
- 3-(Carboxymethylidene)-4,4-diethylmorpholin-4-ium bromide
-
- Inchi： 1S/C10H17NO3.BrH/c1-3-11(4-2)5-6-14-8-9(11)7-10(12)13;/h7H,3-6,8H2,1-2H3;1H
- InChI Key： BPUJGORLNOFWSX-UHFFFAOYSA-N
- SMILES： [Br-].O1CC(=CC(=O)O)[N+](CC)(CC)CC1
Computed Properties
- Exact Mass: 260.9061
- Monoisotopic Mass: 279.04701g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 244
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.2
Morpholinium, 3-(carboxymethylene)-4,4-diethyl-, bromide Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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