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2-Methylheptanoic acid

CAS No.:
1188-02-9
Catalog Number:
AG003HPE
Molecular Formula:
C8H16O2
Molecular Weight:
144.2114
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$57
- +
5g
97%
In Stock USA
United States
$130
- +
Product Description
Catalog Number:
AG003HPE
Chemical Name:
2-Methylheptanoic acid
CAS Number:
1188-02-9
Molecular Formula:
C8H16O2
Molecular Weight:
144.2114
MDL Number:
MFCD00142944
IUPAC Name:
2-methylheptanoic acid
InChI:
InChI=1S/C8H16O2/c1-3-4-5-6-7(2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)
InChI Key:
NKBWMBRPILTCRD-UHFFFAOYSA-N
SMILES:
CCCCCC(C(=O)O)C
EC Number:
214-704-2
FEMA Number:
2706
Properties
Complexity:
99.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.115g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
144.214g/mol
Monoisotopic Mass:
144.115g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
Application of polymethacrylate resin as stationary phase in liquid chromatography with UV detection for C1-C7 aliphatic monocarboxylic acids and C1-C7 aliphatic monoamines. Journal of chromatography. A 20040611
Separation and conductimetric detection of C1-C7 aliphatic monocarboxylic acids and C1-C7 aliphatic monoamines on unfunctionized polymethacrylate resin columns. Journal of chromatography. A 20040611
Properties