Home Other Building Blocks methyl 3,3-difluoro-2,2-dimethylpentanoate

methyl 3,3-difluoro-2,2-dimethylpentanoate

CAS No.:
2044714-02-3
Catalog Number:
AG01B7GA
Molecular Formula:
C8H14F2O2
Molecular Weight:
180.1924
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Product Description
Catalog Number:
AG01B7GA
Chemical Name:
methyl 3,3-difluoro-2,2-dimethylpentanoate
CAS Number:
2044714-02-3
Molecular Formula:
C8H14F2O2
Molecular Weight:
180.1924
MDL Number:
MFCD30476159
IUPAC Name:
methyl 3,3-difluoro-2,2-dimethylpentanoate
InChI:
InChI=1S/C8H14F2O2/c1-5-8(9,10)7(2,3)6(11)12-4/h5H2,1-4H3
InChI Key:
ANXRYZBJGRXLTD-UHFFFAOYSA-N
SMILES:
COC(=O)C(C(CC)(F)F)(C)C
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.096g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.195g/mol
Monoisotopic Mass:
180.096g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties