Home Other Building Blocks 4-methoxy-2,2-dimethylbutanoic acid

4-methoxy-2,2-dimethylbutanoic acid

CAS No.:
1338986-76-7
Catalog Number:
AG01ABKO
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
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Product Description
Catalog Number:
AG01ABKO
Chemical Name:
4-methoxy-2,2-dimethylbutanoic acid
CAS Number:
1338986-76-7
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
MDL Number:
MFCD16855524
IUPAC Name:
4-methoxy-2,2-dimethylbutanoic acid
InChI:
InChI=1S/C7H14O3/c1-7(2,6(8)9)4-5-10-3/h4-5H2,1-3H3,(H,8,9)
InChI Key:
UPLYSUSXVBONEP-UHFFFAOYSA-N
SMILES:
COCCC(C(=O)O)(C)C
Properties
Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.094g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.186g/mol
Monoisotopic Mass:
146.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties