2-METHYLBUTANOIC ACID Next Previous

ChEMBL ID CHEMBL1160012
PubChem CID 8314
DrugBank Accession Number
ClinicalTrials 2-METHYLBUTANOIC ACID
Molecular Formula C5H10O2
Inchikey WLAMNBDJUVNPJU-UHFFFAOYSA-N

Smiles
CCC(C)C(=O)O

Synonyms
2-Methylbutanoic acid, 2-METHYLBUTYRIC ACID, 116-53-0, DL-2-Methylbutyric acid, Butanoic acid, 2-methyl-, Ethylmethylacetic acid, Methylbutyric acid, 2-Methyl butyric acid, 2-Methybutyric acid, Methylethylacetic acid, Active valeric acid, Butyric acid, 2-methyl-, (+/-)-2-Methylbutyric acid, 2-methyl-butanoic acid, 2-methylbutanoate, alpha-Methylbutyric acid, 600-07-7, 2-methylbutans, alpha-methyl butyric Acid, Ethylmethylacetate, 2-Ethylpropionate, Valeric acid, active, 2-Ethylpropionic acid, 2-methyl-butyric acid, NSC 7304, D-2-Methyl Butyric acid, DL-2-Methy Butyric acid, .alpha.-Methylbutyric acid, (1)-2-Methylbutyric acid, 2-Methylbutyric acid (VAN), FEMA No. 2695, 2-Methylbutyric acid (natrual), CHEBI:37070, WLAMNBDJUVNPJU-UHFFFAOYSA-N, EINECS 204-145-2, EINECS 209-982-7, Carbomer 941, MFCD00002669, Butyric acid, 2-methyl- (6CI,8CI), BRN 1098537, AI3-24202, DSSTox_CID_1621, DSSTox_RID_76241, DSSTox_GSID_21621, CAS-116-53-0, (+)-2-methylbutanoic acid, Butanoic acid, 2-methyl-, (S)-, Methylbutyricacid, GC Conditioner, cavity conditioner, carbomer-934, Methyl butyric acid, Pemulen TR-1, Pemulen TR-2, Carbopol 910, Carbopol 934, Carbopol 974P, ACMC-20apgr, Carbomer 1342, Carbopol 1342, PAA20 cpd, PAA60 cpd, ethyl methyl acetic acid, AC1Q5RQD, butane-2-carboxylic acid, Butanoicacid, 2-methyl-, Carbomer 934 [USAN], Carbomer 940 [USAN], Carbomer 934p [USAN], AC1L1QQ8, AC1Q2S2W, SCHEMBL49960, 2-Methyl-Butyric Acid Anion, Nat. 2-Methyl Butyric Acid, (RS)-2-methyl-butyric acid, KSC174S5L, MLS001055480, W269506_ALDRICH, W269514_ALDRICH, 193070_ALDRICH, PAA170, CHEMBL1160012, DTXSID5021621, CTK0H4955, HMDB02176, NSC7304, (.+/-.)-2-Methylbutanoic acid, HMS2270O06, LTBB002136, 2-METHYLBUTANOIC ACID (DL), NSC-7304, NATURAL 2-METHYLBUTYRIC ACID, Tox21_201807, Tox21_303584, ANW-16971, AR-1E3900, LMFA01020072, Butanoic acid, 2-methyl-, (+ -), AKOS000121120, AKOS016843247, DL-ALPHA-METHYL-N-BUTYRIC ACID, LS-2915, MCULE-5615925204, RP18771, TRA0047814, VC31128, NCGC00090971-01, NCGC00090971-02, NCGC00257513-01, NCGC00259356-01, AK-77434, AM802977, AN-21587, AN-22760, AN-49786, KB-25100, LS-14739, OR129719, OR129720, OR206578, SC-22738, SMR000112113, AB1011869, DB-003300, KB-231694, TR-032178, TR-033536, FT-0604458, FT-0605255, FT-0671578, M0181, ST24028102, C18319, 4-02-00-00889 (Beilstein Handbook Reference), A811487, I04-0220, T7100046, I04-12788, F0001-0289, 2-Methylbutanoate

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 0
Molecular Species ACID
Molecular Properties
Molecular Weight 102.13
Rotatable Bonds 2
Acidic pKa (ACD) 4.8
Basic pKa (ACD) -
LogP (ACD) 1.05
LogD (ACD) -1.52
ALogP 1.38
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