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1188-02-9,MFCD00142944
Catalog No.:AA003HMM
1188-02-9 | 2-Methylheptanoic acid
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Purity
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5g
>98.0%(T)(GC)
1 week  
$92.00
- +
25g
>98.0%(T)(GC)
1 week  
$178.00
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HMM
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
Computed 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  

Synonyms
 
2-METHYLHEPTANOIC ACID 
1188-02-9 
NKBWMBRPILTCRD-UHFFFAOYSA-N 
MFCD00142944 
FEMA No. 2706 
Heptanoic acid, 2-methyl-, (2S)- 
EINECS 214-704-2 
Amylmethylacetic acid 
2-MethylheptanoicAcid 
ACMC-20mmgv 
2 methyl heptanoic acid 
ACMC-1BVSV 
2-Methylenanthic acid 
AC1L23WO 
SCHEMBL163171 
CHEMBL1789306 
CTK3I1051 
FEMA 2706 
2-Methylheptanoic acid, >=97% 
116454-37-6 
0668AD 
ANW-17239 
LMFA01020391 
Heptanoic acid, 2-methyl- 
AKOS009156601 
RTR-003201 
TRA0050279 
VZ34771 
KS-000017F8 
AN-20629 
DB-021385 
TR-003201 
FT-0608334 
M1265 
Methylamylacetic acid 
C-5116 
188M029 
W-108536 
I14-13314 
91433-72-6 
UNII-42C9131FOZ 
C8H16O2 
42C9131FOZ 
CID14475 
C8-H16-O2 
2-methyl-heptanoic acid 
FA(8:0) 
40108-12-1 
Heptanoic acid, methyl- 
alpha-Methylheptanoic acid 
2-methyl heptanoic acid 
heptane-2-carboxylic acid 
Literature

Title: 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: Journal of chromatography. A 20040611

Title: Separation and conductimetric detection of C1-C7 aliphatic monocarboxylic acids and C1-C7 aliphatic monoamines on unfunctionized polymethacrylate resin columns.

Journal: Journal of chromatography. A 20040611

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