Home Halogens 3-bromo-1,1,1-trifluoro-2-methylpropane

3-bromo-1,1,1-trifluoro-2-methylpropane

CAS No.:
381-80-6
Catalog Number:
AG01A1RQ
Molecular Formula:
C4H6BrF3
Molecular Weight:
190.9896
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Product Description
Catalog Number:
AG01A1RQ
Chemical Name:
3-bromo-1,1,1-trifluoro-2-methylpropane
CAS Number:
381-80-6
Molecular Formula:
C4H6BrF3
Molecular Weight:
190.9896
MDL Number:
MFCD20625147
IUPAC Name:
3-bromo-1,1,1-trifluoro-2-methylpropane
InChI:
InChI=1S/C4H6BrF3/c1-3(2-5)4(6,7)8/h3H,2H2,1H3
InChI Key:
AANLYORBFNBDGG-UHFFFAOYSA-N
SMILES:
BrCC(C(F)(F)F)C
Properties
Complexity:
68.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.96g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.991g/mol
Monoisotopic Mass:
189.96g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties