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Home Halogens 3-(3-chloropropanoyl)-1-(3,3,3-trifluoropropyl)urea

3-(3-chloropropanoyl)-1-(3,3,3-trifluoropropyl)urea

CAS No.:
1340452-19-8
Catalog Number:
AG01AN97
Molecular Formula:
C7H10ClF3N2O2
Molecular Weight:
246.6147
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Product Description
Catalog Number:
AG01AN97
Chemical Name:
3-(3-chloropropanoyl)-1-(3,3,3-trifluoropropyl)urea
CAS Number:
1340452-19-8
Molecular Formula:
C7H10ClF3N2O2
Molecular Weight:
246.6147
MDL Number:
MFCD18298577
IUPAC Name:
3-chloro-N-(3,3,3-trifluoropropylcarbamoyl)propanamide
InChI:
InChI=1S/C7H10ClF3N2O2/c8-3-1-5(14)13-6(15)12-4-2-7(9,10)11/h1-4H2,(H2,12,13,14,15)
InChI Key:
KWXDDWKPOBGSQY-UHFFFAOYSA-N
SMILES:
ClCCC(=O)NC(=O)NCCC(F)(F)F
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.038g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
246.614g/mol
Monoisotopic Mass:
246.038g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties