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19845-51-3 | Methane, chlorofluorodinitro-
CAS No: 19845-51-3 Catalog No: AG002BJJ MDL No:
Product Description
Catalog Number:
AG002BJJ
Chemical Name:
Methane, chlorofluorodinitro-
CAS Number:
19845-51-3
Molecular Formula:
CClFN2O4
Molecular Weight:
158.4731
IUPAC Name:
chloro-fluoro-dinitromethane
InChI:
InChI=1S/CClFN2O4/c2-1(3,4(6)7)5(8)9
InChI Key:
RGZPRTVWBYQTNT-UHFFFAOYSA-N
SMILES:
FC([N+](=O)[O-])([N+](=O)[O-])Cl
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.953g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.469g/mol
Monoisotopic Mass:
157.953g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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