Cas no 18804-91-6 (Carbamic acid, formyl-,ethyl ester (6CI,8CI,9CI))
18804-91-6 structure
Product Name:Carbamic acid, formyl-,ethyl ester (6CI,8CI,9CI)
CAS No:18804-91-6
MF:C4H7NO3
MW:117.103281259537
CID:141595
PubChem ID:227996
Update Time:2025-04-19
Carbamic acid, formyl-,ethyl ester (6CI,8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid, formyl-,ethyl ester (6CI,8CI,9CI)
- ethyl N-formylcarbamate
- ethyl formylcarbamate
- ethyl N-carbonylcarbamate
- formyl-carbamic acid ethyl ester
- Formyl-carbamidsaeure-aethylester
- Formyl-urethan
- N-formylaminoformate
- N-Formylcarbaminsaeureethylester
- 18804-91-6
- AKOS006346884
- ethylformylcarbamate
- NSC20519
- SCHEMBL20956383
- SCHEMBL1555583
- NSC-20519
-
- Inchi： 1S/C4H7NO3/c1-2-8-4(7)5-3-6/h3H,2H2,1H3,(H,5,6,7)
- InChI Key： FOIOWCBPOAJVPZ-UHFFFAOYSA-N
- SMILES： O(C(NC=O)=O)CC
Computed Properties
- Exact Mass: 117.04261
- Monoisotopic Mass: 117.043
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 8
- Rotatable Bond Count: 2
- Complexity: 91.3
- 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
- XLogP3: 0.1
- Topological Polar Surface Area: 55.4?2
Experimental Properties
- Density: 1.124
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.415
- PSA: 55.4
Carbamic acid, formyl-,ethyl ester (6CI,8CI,9CI) Related Literature
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1. LVI.—The action of ethyl carbamate on esters of organic acids and mustard oilsSiegfried Ruhemann,John Gillies Priestley J. Chem. Soc. Trans. 1909 95 449
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2. Meso-ionic compounds. Part 12. Synthesis of 1-alkyl-4-oxopyrimido-[1,2-a]-S-triaziniumolates and their 4-thio-derivativesClaude V. Greco,Kanti J. Gala J. Chem. Soc. Perkin Trans. 1 1981 331
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Taisuke Hirano,Kenji Kuroda,Masanori Kataoka,Yoshihiro Hayakawa Org. Biomol. Chem. 2009 7 2905
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Daniel J. Foley,Richard G. Doveston,Ian Churcher,Adam Nelson,Stephen P. Marsden Chem. Commun. 2015 51 11174
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5. Gas phase chemistry of the heterocumulene cations OCN+CO and OCCN+OMárcia C. Carvalho,Valmir F. Juliano,Concetta Kascheres,Marcos N. Eberlin J. Chem. Soc. Perkin Trans. 2 1997 2347
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