Basic information
- CAS
71254-75-6- Standard SMILES
CCOC(=O)c1ccc(N2CCOCC2)c(N)c1- InChIKey
BFHAMNGFRPDRGR-UHFFFAOYSA-N- Molecular formula
- C13H18N2O3
- Average molar mass
- 250.29 g/mol
- Monoisotopic mass
- 250.13174244
Names & identifiers
- Preferred name
- Ethyl 3-amino-4-morpholinobenzoate
- IUPAC
- ethyl 3-amino-4-morpholin-4-ylbenzoate
- English name
- 3-Amino-4-morpholin-4-yl-benzoic acid ethyl ester
- Molecular formula
- C13H18N2O3
- Molecular weight
- 250.29
Names & synonyms
71254-75-6ETHYL 3-AMINO-4-MORPHOLINOBENZOATEethyl 3-amino-4-morpholin-4-ylbenzoateethyl 3-amino-4-(morpholin-4-yl)benzoateEthyl 3-amino-4-(4-morpholinyl)benzoateEthyl 3-amino-4-morpholino-benzoateMaybridge1_004067Oprea1_065195HMS553A21DTXSID80384779BBL008023CCG-49863
Show more names
AKOS BB-7695ASISCHEM B674133-Amino-4-morpholin-4-yl-benzoic acid ethyl esterBenzoic acid, 3-amino-4-(4-morpholinyl)-, ethyl ester
MFCD00277379SBB100763STK220382AKOS000107942ETHYL3-AMINO-4-MORPHOLINOBENZOATEVS-01788DB-074406CS-0314594
Database identifiers
- CAS
71254-75-6- PubChem CID
- 2818618
- DTXSID
DTXSID80384779
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 64.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 279
Physicochemical properties
- HazardClass
- IRRITANT
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
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers4 total
南通华祥医药科技有限公司+86-15716293042 15716293042 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
江西优垦生物科技有限公司15107073929 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…