Home Halogens 1,1-dichloro-2,2,2-trifluoro-1-isocyanatoethane

1,1-dichloro-2,2,2-trifluoro-1-isocyanatoethane

CAS No.:
116942-59-7
Catalog Number:
AG01B6VA
Molecular Formula:
C3Cl2F3NO
Molecular Weight:
193.9394
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Product Description
Catalog Number:
AG01B6VA
Chemical Name:
1,1-dichloro-2,2,2-trifluoro-1-isocyanatoethane
CAS Number:
116942-59-7
Molecular Formula:
C3Cl2F3NO
Molecular Weight:
193.9394
MDL Number:
MFCD06762715
IUPAC Name:
1,1-dichloro-2,2,2-trifluoro-1-isocyanatoethane
InChI:
InChI=1S/C3Cl2F3NO/c4-2(5,9-1-10)3(6,7)8
InChI Key:
RKWNLYRUPNZVJP-UHFFFAOYSA-N
SMILES:
O=C=NC(C(F)(F)F)(Cl)Cl
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.931g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.934g/mol
Monoisotopic Mass:
192.931g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties