Home Other Building Blocks 2,2-difluorobutane-1,4-diol

2,2-difluorobutane-1,4-diol

CAS No.:
108781-20-0
Catalog Number:
AG01DXAD
Molecular Formula:
C4H8F2O2
Molecular Weight:
126.1019
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Product Description
Catalog Number:
AG01DXAD
Chemical Name:
2,2-difluorobutane-1,4-diol
CAS Number:
108781-20-0
Molecular Formula:
C4H8F2O2
Molecular Weight:
126.1019
MDL Number:
MFCD28975581
IUPAC Name:
2,2-difluorobutane-1,4-diol
InChI:
InChI=1S/C4H8F2O2/c5-4(6,3-8)1-2-7/h7-8H,1-3H2
InChI Key:
LUHHBDLSEBKKQX-UHFFFAOYSA-N
SMILES:
OCCC(CO)(F)F
Properties
Complexity:
65.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.049g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
126.103g/mol
Monoisotopic Mass:
126.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties