Basic information
- CAS
78191-05-6- Standard SMILES
CONCCC(=O)OC- InChIKey
MCRHBOCDCFCGDP-UHFFFAOYSA-N- Molecular formula
- C5H11NO3
- Average molar mass
- 133.15 g/mol
- Monoisotopic mass
- 133.07389321
Names & identifiers
- Preferred name
- Methyl 3-(methoxyamino)propanoate
- IUPAC
- methyl 3-(methoxyamino)propanoate
Names & synonyms
methyl 3-(methoxyamino)propanoate78191-05-6RefChem:815038995-242-5Methyl 3-methoxyamino-propanoatemethyl3-(methoxyamino)propanoateSCHEMBL2149087MCRHBOCDCFCGDP-UHFFFAOYSA-NDDA19105AKOS009095093CS-0253023EN300-6230230
Database identifiers
- CAS
78191-05-6- PubChem CID
- 548251
- EC Number
- 995-242-5
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 84.3
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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 CategoriesFlam. Liq. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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