2-Hydroxy-2-methylpentanoic acid
Basic information
- CAS
28892-68-4- Standard SMILES
CCCC(C)(O)C(=O)O- InChIKey
BIEZUWIUHAKFHZ-UHFFFAOYSA-N- Molecular formula
- C6H12O3
- Average molar mass
- 132.16 g/mol
- Monoisotopic mass
- 132.07864424
Names & identifiers
- Preferred name
- 2-Hydroxy-2-methylpentanoic acid
- IUPAC
- 2-hydroxy-2-methylpentanoic acid
- English name
- 2-hydroxy-2-methylPentanoic acid
- Molecular formula
- C6H12O3
- Molecular weight
- 132.16
Names & synonyms
2-hydroxy-2-methylpentanoic acid28892-68-4DTXSID20330093RefChem:261622DTXCID302811882-hydroxy-2-methyl-pentanoic acidNSC189698SCHEMBL3815122- Hydroxy-2-methylpentansaure2-hydroxy-2-methylpentanoicacid2-hydroxy-2-methyl-valeric acidDBA89268
Show more names
Pentanoic acid, 2-hydroxy-2-methyl-
AKOS010488735NSC-189698DA-26145EN300-112800G48180Z788000960
Database identifiers
- CAS
28892-68-4- PubChem CID
- 426396
- DTXSID
DTXSID20330093- Nikkaji
- J1.089.116G
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 111
Physicochemical properties
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…