Home Other Building Blocks 2-ethyl-4,4-difluorobutan-1-ol

2-ethyl-4,4-difluorobutan-1-ol

CAS No.:
1909305-27-6
Catalog Number:
AG01C5BE
Molecular Formula:
C6H12F2O
Molecular Weight:
138.1557
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Product Description
Catalog Number:
AG01C5BE
Chemical Name:
2-ethyl-4,4-difluorobutan-1-ol
CAS Number:
1909305-27-6
Molecular Formula:
C6H12F2O
Molecular Weight:
138.1557
MDL Number:
MFCD29763363
IUPAC Name:
2-ethyl-4,4-difluorobutan-1-ol
InChI:
InChI=1S/C6H12F2O/c1-2-5(4-9)3-6(7)8/h5-6,9H,2-4H2,1H3
InChI Key:
BRWNJABKAKAWGU-UHFFFAOYSA-N
SMILES:
CCC(CC(F)F)CO
Properties
Complexity:
66.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.086g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
138.158g/mol
Monoisotopic Mass:
138.086g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties