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188680-93-5

188680-93-5 | Carbonic acid, 2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl ethyl ester

CAS No: 188680-93-5 Catalog No: AG002H57 MDL No:

Product Description

Catalog Number:
AG002H57
Chemical Name:
Carbonic acid, 2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl ethyl ester
CAS Number:
188680-93-5
Molecular Formula:
C9H11NO5
Molecular Weight:
213.1873
IUPAC Name:
2-(2,5-dioxopyrrol-1-yl)ethyl ethyl carbonate
InChI:
InChI=1S/C9H11NO5/c1-2-14-9(13)15-6-5-10-7(11)3-4-8(10)12/h3-4H,2,5-6H2,1H3
InChI Key:
ZGBDLHQEJJDYBR-UHFFFAOYSA-N
SMILES:
CCOC(=O)OCCN1C(=O)C=CC1=O

Properties

Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.064g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.189g/mol
Monoisotopic Mass:
213.064g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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