tert-Butyl 2-(bromomethyl)morpholine-4-carboxylate

HCID 57418765

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Grundinformationen

CAS: 765914-78-1
Standard-SMILES: CC(C)(C)OC(=O)N1CCOC(CBr)C1
InChIKey: RLXCSEPIBOWMOJ-UHFFFAOYSA-N
Summenformel: C10H18BrNO3
Durchschnittliche Molmasse: 280,16 g/mol
Monoisotopische Masse: 279,04701

Namen und Bezeichner

Bevorzugter Name: tert-Butyl 2-(bromomethyl)morpholine-4-carboxylate
IUPAC: tert-butyl 2-(bromomethyl)morpholine-4-carboxylate
Englischer Name: 4-Boc-2-(broMoMethyl)Morpholine
Summenformel: C10H18BrNO3
Molmasse: 280.16

Namen und Synonyme

765914-78-1tert-butyl 2-(bromomethyl)morpholine-4-carboxylateDTXSID80726276RefChem:383170DTXCID70677021831-082-34-Boc-2-(bromomethyl)morpholineMFCD20489326C10H18BrNO3N-BOC-(2)-(BROMOMETHYL)MORPHOLINESCHEMBL24444204-Morpholinecarboxylic acid, 2-(bromomethyl)-, 1,1-dimethylethyl ester

Weitere Namen anzeigen

4-Boc-broMoMethylMorpholine2-Bromomethylmorpholine-4-carboxylic acid tert-butyl ester

4-Boc-2-(bromomethyl)-morpholine(R)-tert-Butyl 2-(bromomethyl)-morpholine-4-carboxylateRLXCSEPIBOWMOJ-UHFFFAOYSA-NQFB91478ULB28658AKOS016002111PB43842SB47483

Datenbank-Bezeichner

CAS: 765914-78-1
PubChem CID: 57418765
DTXSID: DTXSID80726276
EC Number: 831-082-3

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,6
Polarare Oberfläche (TPSA): 38,8 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 3
Schwere Atome: 15
Formalladung: 0
Komplexität: 227

Physikochemische Eigenschaften

Siedepunkt: 328.8 · 328.8±32.0 °C(Predicted)
Dichte: 1.334 · 1.334±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
pka: -2.34 · -2.34±0.40(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, 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.