Pentanoic acid, 2-(1-methylethyl)-


Chemical Name: Pentanoic acid, 2-(1-methylethyl)-
CAS Number: 62391-99-5
Product Number: AG00EEOZ(AGN-PC-0JMVNT)
Synonyms:
MDL No:
Molecular Formula: C8H16O2
Molecular Weight: 144.21144

Identification/Properties


Computed Properties
Molecular Weight:
144.214g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
144.115g/mol
Monoisotopic Mass:
144.115g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
108
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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