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89307-25-5

89307-25-5 | Benzeneacetic acid, a-[[[(2-furanylcarbonyl)amino]carbonyl]amino]-

CAS No: 89307-25-5 Catalog No: AG0040G6 MDL No:MFCD09954488

Product Description

Catalog Number:
AG0040G6
Chemical Name:
Benzeneacetic acid, a-[[[(2-furanylcarbonyl)amino]carbonyl]amino]-
CAS Number:
89307-25-5
Molecular Formula:
C14H12N2O5
Molecular Weight:
288.2555
MDL Number:
MFCD09954488
IUPAC Name:
2-(furan-2-carbonylcarbamoylamino)-2-phenylacetic acid
InChI:
InChI=1S/C14H12N2O5/c17-12(10-7-4-8-21-10)16-14(20)15-11(13(18)19)9-5-2-1-3-6-9/h1-8,11H,(H,18,19)(H2,15,16,17,20)
InChI Key:
OHBHOADQJUEVFG-UHFFFAOYSA-N
SMILES:
O=C(NC(=O)c1ccco1)NC(c1ccccc1)C(=O)O

Properties

Complexity:
406  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.075g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
288.259g/mol
Monoisotopic Mass:
288.075g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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