4-Benzylmorpholine-2-carboxylic acid hydrochloride

HCID 2776352

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Basic information

CAS: 135072-15-0
Standard SMILES: Cl.O=C(O)C1CN(Cc2ccccc2)CCO1
InChIKey: CEDXMALCJZSQHA-UHFFFAOYSA-N
Molecular formula: C12H16ClNO3
Average molar mass: 257.71 g/mol
Monoisotopic mass: 257.08187105

Names & identifiers

Preferred name: 4-Benzylmorpholine-2-carboxylic acid hydrochloride
IUPAC: 4-benzylmorpholine-2-carboxylic acid;hydrochloride
English name: 4-BENZYL-2-MORPHOLINECARBOXYLIC ACID HYDROCHLORIDE
Molecular formula: C12H16ClNO3
Molecular weight: 257.71

Names & synonyms

4-Benzylmorpholine-2-carboxylic acid hydrochlorideRefChem:518506691-133-9135072-15-04-Benzyl-2-morpholinecarboxylic Acid HydrochlorideMFCD026820314-benzylmorpholine-2-carboxylic acid;hydrochlorideCS-W002954TS-034704-BENZYL-2-MORPHOLINECARBOXYLIC ACID HCl2-Morpholinecarboxylic acid, 4-(phenylmethyl)-, hydrochloride4-Benzylmorpholine-2-carboxylicacidhydrochloride

Show more names

4-Benzyl-2-morpholinecarboxylicacidHCl4-Benzyl-2-carboxymorpholine hydrochlorideBENZYL(N-)-MORPHOLINE-2-CARBOXYLIC ACID HCL4-Benzylmorpholine-2-carboxylicacidhydrochloride,97%4-Benzyl-2-morpholinecarboxylic acid hydrochloride, 90+%4-Benzyl-2-carboxymorpholine hydrochloride, 10 mM in DMSO4-(phenylmethyl)-2-Morpholinecarboxylic acid hydrochloride (1:1)

4-Benzyl-morpholine-2-carboxylic acid hydrochlorideSCHEMBL917642orb1220148orb1298953DTXSID30380009CEDXMALCJZSQHA-UHFFFAOYSA-NSBB101921AKOS015847212

Database identifiers

CAS: 135072-15-0
PubChem CID: 2776352
DTXSID: DTXSID30380009
EC Number: 691-133-9

Properties

Computed structural properties

Topological polar surface area: 49.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 17
Formal charge: 0
Complexity: 238

Physicochemical properties

Melting point: 244 °C · 244 °C
storage temp.: Sealed in dry,Room Temperature
form: solid
color: Brown
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H312-H315-H319-H332-H335
Precautionary statements: 261 · P261-P280-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes: Xn
Risk Statements: 36 · 36/37/38-20/21/22
Safety Statements: 26 · 26-36/37/39
Hazard Note: Harmful
HazardClass: 6.1 · 6.1
HS Code: 2934999090 · 2934999090

Safety & regulation

GHS classification

GHS Classification · 4 items

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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.