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(2,6-difluorobenzoyl)urea

CAS No.:
1342075-20-0
Catalog Number:
AG019ZWO
Molecular Formula:
C8H6F2N2O2
Molecular Weight:
200.1422
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Product Description
Catalog Number:
AG019ZWO
Chemical Name:
(2,6-difluorobenzoyl)urea
CAS Number:
1342075-20-0
Molecular Formula:
C8H6F2N2O2
Molecular Weight:
200.1422
IUPAC Name:
N-carbamoyl-2,6-difluorobenzamide
InChI:
InChI=1S/C8H6F2N2O2/c9-4-2-1-3-5(10)6(4)7(13)12-8(11)14/h1-3H,(H3,11,12,13,14)
InChI Key:
PPOSFCNLNROPTA-UHFFFAOYSA-N
SMILES:
O=C(c1c(F)cccc1F)NC(=O)N
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.145g/mol
Monoisotopic Mass:
200.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties