Home Other Building Blocks 3,3-difluoro-2,2-dimethylbutan-1-ol

3,3-difluoro-2,2-dimethylbutan-1-ol

CAS No.:
1955548-09-0
Catalog Number:
AG01B5B0
Molecular Formula:
C6H12F2O
Molecular Weight:
138.1557
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Product Description
Catalog Number:
AG01B5B0
Chemical Name:
3,3-difluoro-2,2-dimethylbutan-1-ol
CAS Number:
1955548-09-0
Molecular Formula:
C6H12F2O
Molecular Weight:
138.1557
MDL Number:
MFCD29991993
IUPAC Name:
3,3-difluoro-2,2-dimethylbutan-1-ol
InChI:
InChI=1S/C6H12F2O/c1-5(2,4-9)6(3,7)8/h9H,4H2,1-3H3
InChI Key:
SFXCMNDWWYEUHB-UHFFFAOYSA-N
SMILES:
OCC(C(F)(F)C)(C)C
Properties
Complexity:
99.2  
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:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties