Benzyl 3-(hydroxymethyl)morpholine-4-carboxylate
Basic information
- CAS
1596871-45-2- Standard SMILES
O=C(OCc1ccccc1)N1CCOCC1CO- InChIKey
FDIAPFRJARUCGP-UHFFFAOYSA-N- Molecular formula
- C13H17NO4
- Average molar mass
- 251.28 g/mol
- Monoisotopic mass
- 251.11575802
Names & identifiers
- Preferred name
- Benzyl 3-(hydroxymethyl)morpholine-4-carboxylate
- IUPAC
- benzyl 3-(hydroxymethyl)morpholine-4-carboxylate
Names & synonyms
benzyl 3-(hydroxymethyl)morpholine-4-carboxylate1596871-45-2AB88624EN300-4426668
Database identifiers
- CAS
1596871-45-2- PubChem CID
- 108485244
- EC Number
- 179-879-9
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 266
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+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 CategoriesAcute Tox. 4 (100%)
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Related reactions
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Compound notes
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