Home Other Building Blocks 4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl N-phenylcarbamate

4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl N-phenylcarbamate

CAS No.:
95498-20-7
Catalog Number:
AG01BXWQ
Molecular Formula:
C17H12N2O4
Molecular Weight:
308.2882
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Product Description
Catalog Number:
AG01BXWQ
Chemical Name:
4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl N-phenylcarbamate
CAS Number:
95498-20-7
Molecular Formula:
C17H12N2O4
Molecular Weight:
308.2882
MDL Number:
MFCD00401152
IUPAC Name:
[4-(2,5-dioxopyrrol-1-yl)phenyl] N-phenylcarbamate
InChI:
InChI=1S/C17H12N2O4/c20-15-10-11-16(21)19(15)13-6-8-14(9-7-13)23-17(22)18-12-4-2-1-3-5-12/h1-11H,(H,18,22)
InChI Key:
FLMJKAYWSNAGDG-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)Oc1ccc(cc1)N1C(=O)C=CC1=O
Properties
Complexity:
485  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.08g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
308.293g/mol
Monoisotopic Mass:
308.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
75.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties