200,000+ products from a single source!
sales@angenechem.com
13991-76-9 | Urea, N-(2-chloroethyl)-N-nitroso-N'-[4-(trifluoromethyl)phenyl]-
CAS No: 13991-76-9 Catalog No: AG001BSO MDL No:
Product Description
Catalog Number:
AG001BSO
Chemical Name:
Urea, N-(2-chloroethyl)-N-nitroso-N'-[4-(trifluoromethyl)phenyl]-
CAS Number:
13991-76-9
Molecular Formula:
C10H9ClF3N3O2
Molecular Weight:
295.6456
IUPAC Name:
1-(2-chloroethyl)-1-nitroso-3-[4-(trifluoromethyl)phenyl]urea
InChI:
InChI=1S/C10H9ClF3N3O2/c11-5-6-17(16-19)9(18)15-8-3-1-7(2-4-8)10(12,13)14/h1-4H,5-6H2,(H,15,18)
InChI Key:
XNFVUJQRDLTCNW-UHFFFAOYSA-N
SMILES:
ClCCN(C(=O)Nc1ccc(cc1)C(F)(F)F)N=O
NSC Number:
83107
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.034g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.646g/mol
Monoisotopic Mass:
295.034g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.