Pentanoic acid, 2-hydroxy-4-methyl-


Chemical Name: Pentanoic acid, 2-hydroxy-4-methyl-
CAS Number: 498-36-2
Product Number: AG00DE69(AGN-PC-0JLUPI)
Synonyms:
MDL No:
Molecular Formula: C6H12O3
Molecular Weight: 132.15768

Identification/Properties


Computed Properties
Molecular Weight:
132.159g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
132.079g/mol
Monoisotopic Mass:
132.079g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
98.5
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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