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pivalic acid

Properties Image MNX_ID MNXM160294 reference chebi:45133 formula C5H10O2 global charge 0 mol weight 102.133 InChIKey IUGYQRQAERSCNH-UHFFFAOYSA-N InChI InChI=1S/C5H10O2/c1-5(2,3)4(6)7/h1-3H3,(H,6,7) SMILES CC(C)(C)C(=O)O MNX internals InChI (mnx) InChI=1/C5H10O2/c1-5(2,3)4(6)7/h1-3H3,(H,6,7) SMILES (mnx) [CH3:1][C:5]([CH3:2])([CH3:3])[C:4]([OH:6])=[O:7]
Parent-child relations graph	Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
CHEBI:45133 chebi:45133 IUGYQRQAERSCNH-UHFFFAOYSA-N	pivalic acid 2,2-dimethylpropanoic acid 2,2-dimethylpropionic acid PIVALIC ACID Pivalinsaeure acide 2,2-dimethylpropanoique acide pivalique acido pivalico alpha,alpha-dimethylpropionic acid dimethylpropionic acid neopentanoic acid tert-pentanoic acid trimethylacetic acid
seed.compound:cpd34401 seedM:cpd34401 IUGYQRQAERSCNH-UHFFFAOYSA-M	2,2-dimethylpropanoate pivalate pivalic acid
envipath:...4334198a5301 envipathM:...4334198a5301 IUGYQRQAERSCNH-UHFFFAOYSA-M	Pivalate
hmdb:HMDB0041992 IUGYQRQAERSCNH-UHFFFAOYSA-N	Pivalic acid 2,2-Dimethyl-propanoic acid 2,2-Dimethyl-propionic acid 2,2-Dimethylpropanoic acid 2,2-Dimethylpropionate 2,2-Dimethylpropionic acid 2,2-dimethylpropanoic acid Acide 2,2-dimethylpropanoique Acide pivalique Acido pivalico Dimethylpropionate Dimethylpropionic acid Kyselina 2,2-dimethylpropionova Kyselina pivalova Neopentanoate Neopentanoic acid Neovaleric acid Pivalate Pivalic acid (acd/name 4.0) Pivalic acid, sodium salt Pivalinsaeure Pivalinsaure Tert-C4H9COOH Tert-pentanoate Tert-pentanoic acid Trimethyl-acetic acid Trimethylacetate Trimethylacetic acid Versatic 5 a,a-Dimethylpropionate a,a-Dimethylpropionic acid alpha,alpha-Dimethylpropionate alpha,alpha-Dimethylpropionic acid alpha,alpha-dimethylpropionate alpha,alpha-dimethylpropionic acid pivalic acid
lipidmaps:LMFA01020073 lipidmapsM:LMFA01020073 IUGYQRQAERSCNH-UHFFFAOYSA-N	Pivalic acid 2,2-dimethyl-propanoic acid FA 5:0
envipath:...79102236697a envipathM:...79102236697a IUGYQRQAERSCNH-UHFFFAOYSA-M	compound 0099000
CHEBI:63894 chebi:63894 IUGYQRQAERSCNH-UHFFFAOYSA-M	pivalate 2,2-dimethylpropanoate 2,2-dimethylpropionate alpha,alpha-dimethylpropanoate alpha,alpha-dimethylpropionate neopentanoate trimethylacetate
metacyc.compound:CPD-19875 metacycM:CPD-19875 IUGYQRQAERSCNH-UHFFFAOYSA-M	pivalate 2,2-dimethylpropanoate pivalic acid
vmhM:piva vmhM:piva vmhmetabolite:piva vmhmetabolite:piva IUGYQRQAERSCNH-UHFFFAOYSA-M	pivalic acid
hmdb:HMDB41992 chebi:35815 chebi:45132 seedM:M_cpd34401 vmhM:M_piva	secondary/obsolete/fantasy identifier