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10191-24-9

10191-24-9 | Hexanoic acid, 3-hydroxy-

CAS No: 10191-24-9 Catalog No: AG0005XG MDL No:MFCD02259045

Product Description

Catalog Number:
AG0005XG
Chemical Name:
Hexanoic acid, 3-hydroxy-
CAS Number:
10191-24-9
Molecular Formula:
C6H12O3
Molecular Weight:
132.1577
MDL Number:
MFCD02259045
IUPAC Name:
3-hydroxyhexanoic acid
InChI:
InChI=1S/C6H12O3/c1-2-3-5(7)4-6(8)9/h5,7H,2-4H2,1H3,(H,8,9)
InChI Key:
HPMGFDVTYHWBAG-UHFFFAOYSA-N
SMILES:
CCCC(CC(=O)O)O

Properties

Complexity:
90.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
132.159g/mol
Monoisotopic Mass:
132.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

Literature

Title Journal
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