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13908-91-3

13908-91-3 | Urea, N,N'-bis(2-fluoroethyl)-N'-nitroso-

CAS No: 13908-91-3 Catalog No: AG001A7R MDL No:

Product Description

Catalog Number:
AG001A7R
Chemical Name:
Urea, N,N'-bis(2-fluoroethyl)-N'-nitroso-
CAS Number:
13908-91-3
Molecular Formula:
C5H9F2N3O2
Molecular Weight:
181.1407
IUPAC Name:
1,3-bis(2-fluoroethyl)-1-nitrosourea
InChI:
InChI=1S/C5H9F2N3O2/c6-1-3-8-5(11)10(9-12)4-2-7/h1-4H2,(H,8,11)
InChI Key:
GWRLHZIGYXCDKL-UHFFFAOYSA-N
SMILES:
FCCNC(=O)N(CCF)N=O
NSC Number:
91728

Properties

Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.066g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.143g/mol
Monoisotopic Mass:
181.066g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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