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