Home Other Building Blocks 3,3,4,4-tetrafluorobutan-1-ol

3,3,4,4-tetrafluorobutan-1-ol

CAS No.:
428-90-0
Catalog Number:
AG01BI32
Molecular Formula:
C4H6F4O
Molecular Weight:
146.0835
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Product Description
Catalog Number:
AG01BI32
Chemical Name:
3,3,4,4-tetrafluorobutan-1-ol
CAS Number:
428-90-0
Molecular Formula:
C4H6F4O
Molecular Weight:
146.0835
MDL Number:
MFCD31735760
IUPAC Name:
3,3,4,4-tetrafluorobutan-1-ol
InChI:
InChI=1S/C4H6F4O/c5-3(6)4(7,8)1-2-9/h3,9H,1-2H2
InChI Key:
ISIBHDNEXXBQIY-UHFFFAOYSA-N
SMILES:
OCCC(C(F)F)(F)F
Properties
Complexity:
82.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.035g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.085g/mol
Monoisotopic Mass:
146.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties