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13907-91-0 | Urea, N-(2-fluoroethyl)-N'-methyl-
CAS No: 13907-91-0 Catalog No: AG001A5X MDL No:
Product Description
Catalog Number:
AG001A5X
Chemical Name:
Urea, N-(2-fluoroethyl)-N'-methyl-
CAS Number:
13907-91-0
Molecular Formula:
C4H9FN2O
Molecular Weight:
120.1255
IUPAC Name:
1-(2-fluoroethyl)-3-methylurea
InChI:
InChI=1S/C4H9FN2O/c1-6-4(8)7-3-2-5/h2-3H2,1H3,(H2,6,7,8)
InChI Key:
MFXZOMNMWJPMMG-UHFFFAOYSA-N
SMILES:
CNC(=O)NCCF
NSC Number:
87976
Properties
Complexity:
76.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.07g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
120.127g/mol
Monoisotopic Mass:
120.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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