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155957-60-1

155957-60-1 | 1-Butanol, 4-bromo-4,4-difluoro-

CAS No: 155957-60-1 Catalog No: AG001ODN MDL No:

Product Description

Catalog Number:
AG001ODN
Chemical Name:
1-Butanol, 4-bromo-4,4-difluoro-
CAS Number:
155957-60-1
Molecular Formula:
C4H7BrF2O
Molecular Weight:
188.9986
IUPAC Name:
4-bromo-4,4-difluorobutan-1-ol
InChI:
InChI=1S/C4H7BrF2O/c5-4(6,7)2-1-3-8/h8H,1-3H2
InChI Key:
YMVXWKFHZLGKAX-UHFFFAOYSA-N
SMILES:
OCCCC(Br)(F)F

Properties

Complexity:
67.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.965g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189g/mol
Monoisotopic Mass:
187.965g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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