Home Other Building Blocks 2-Hydroxy-2-propyl-pentanoic acid

2-Hydroxy-2-propyl-pentanoic acid

CAS No.:
3639-22-3
Catalog Number:
AG0033C7
Molecular Formula:
C8H16O3
Molecular Weight:
160.2108
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Product Description
Catalog Number:
AG0033C7
Chemical Name:
2-Hydroxy-2-propyl-pentanoic acid
CAS Number:
3639-22-3
Molecular Formula:
C8H16O3
Molecular Weight:
160.2108
MDL Number:
MFCD00068930
IUPAC Name:
2-hydroxy-2-propylpentanoic acid
InChI:
InChI=1S/C8H16O3/c1-3-5-8(11,6-4-2)7(9)10/h11H,3-6H2,1-2H3,(H,9,10)
InChI Key:
QFLVRKWAUNYOIV-UHFFFAOYSA-N
SMILES:
CCCC(C(=O)O)(CCC)O
NSC Number:
229295
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.11g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
160.213g/mol
Monoisotopic Mass:
160.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties