Home Other Building Blocks 2-hydroxy-3,3-dimethylpentanoic acid

2-hydroxy-3,3-dimethylpentanoic acid

CAS No.:
874124-84-2
Catalog Number:
AG01B2HB
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
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Product Description
Catalog Number:
AG01B2HB
Chemical Name:
2-hydroxy-3,3-dimethylpentanoic acid
CAS Number:
874124-84-2
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
MDL Number:
MFCD19229012
IUPAC Name:
2-hydroxy-3,3-dimethylpentanoic acid
InChI:
InChI=1S/C7H14O3/c1-4-7(2,3)5(8)6(9)10/h5,8H,4H2,1-3H3,(H,9,10)
InChI Key:
PRTNGLKYNXZIKS-UHFFFAOYSA-N
SMILES:
CCC(C(C(=O)O)O)(C)C
Properties
Complexity:
129  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
146.186g/mol
Monoisotopic Mass:
146.094g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties