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13908-32-2 | Urea, N-(2-chloroethyl)-N'-(4-fluorophenyl)-
CAS No: 13908-32-2 Catalog No: AG001A69 MDL No:MFCD03787786
Product Description
Catalog Number:
AG001A69
Chemical Name:
Urea, N-(2-chloroethyl)-N'-(4-fluorophenyl)-
CAS Number:
13908-32-2
Molecular Formula:
C9H10ClFN2O
Molecular Weight:
216.6399
MDL Number:
MFCD03787786
IUPAC Name:
1-(2-chloroethyl)-3-(4-fluorophenyl)urea
InChI:
InChI=1S/C9H10ClFN2O/c10-5-6-12-9(14)13-8-3-1-7(11)2-4-8/h1-4H,5-6H2,(H2,12,13,14)
InChI Key:
NQVQWNNGRKPRIW-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)Nc1ccc(cc1)F
NSC Number:
83106
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.047g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.64g/mol
Monoisotopic Mass:
216.047g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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