Basic information
- CAS
5405-44-7- Standard SMILES
COC(C)C(O)C(=O)O- InChIKey
HXGKXDWXDMCHDY-UHFFFAOYSA-N- Molecular formula
- C5H10O4
- Average molar mass
- 134.13 g/mol
- Monoisotopic mass
- 134.0579088
Names & identifiers
- Preferred name
- 2-Hydroxy-3-methoxybutanoic acid
- IUPAC
- 2-hydroxy-3-methoxybutanoic acid
Names & synonyms
2-hydroxy-3-methoxybutanoic acid5405-44-7DTXSID10278536RefChem:261661DTXCID60229694889-972-2NSC81192-hydroxy-3-methoxybutanoicacidSCHEMBL28555332FAA40544NSC-8119AKOS030614420
Show more names
EN300-220194Z1509040637
Database identifiers
- CAS
5405-44-7- PubChem CID
- 222292
- DTXSID
DTXSID10278536- EC Number
- 889-972-2
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 101
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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