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17751-24-5 | Urea, N-[(2,6-difluorophenyl)methyl]-
CAS No: 17751-24-5 Catalog No: AG0025DK MDL No:
Product Description
Catalog Number:
AG0025DK
Chemical Name:
Urea, N-[(2,6-difluorophenyl)methyl]-
CAS Number:
17751-24-5
Molecular Formula:
C8H8F2N2O
Molecular Weight:
186.1587
IUPAC Name:
(2,6-difluorophenyl)methylurea
InChI:
InChI=1S/C8H8F2N2O/c9-6-2-1-3-7(10)5(6)4-12-8(11)13/h1-3H,4H2,(H3,11,12,13)
InChI Key:
XJGQUIHBNMXOQE-UHFFFAOYSA-N
SMILES:
NC(=O)NCc1c(F)cccc1F
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.06g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.162g/mol
Monoisotopic Mass:
186.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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