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4-(2-Bromobenzyl)morpholine

HCID 2845477
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
91130-51-7
Standard SMILES
Brc1ccccc1CN1CCOCC1
InChIKey
RFCVOGXWQWZLPA-UHFFFAOYSA-N
Molecular formula
C11H14BrNO
Average molar mass
256.14 g/mol
Monoisotopic mass
255.02588

Names & identifiers

Preferred name
4-(2-Bromobenzyl)morpholine
IUPAC
4-[(2-bromophenyl)methyl]morpholine
English name
4-(2-Bromobenzyl)morpholine
Molecular formula
C11H14BrNO
Molecular weight
256.14

Names & synonyms

4-(2-Bromobenzyl)morpholine91130-51-7DTXSID20385841RefChem:287099DTXCID303368644-[(2-bromophenyl)methyl]morpholine4-(2-BROMOPHENYLMETHYL)MORPHOLINEMFCD009792941-bromo-2-[(morpholin-4-yl)methyl]benzeneOprea1_849694SCHEMBL4100083SCHEMBL7446492
Show more names
4-(2-Bromo-benzyl)-morpholineCHEMBL4452645RFCVOGXWQWZLPA-UHFFFAOYSA-NAKOS000320960AB07884PS-4945Morpholine, 4-[(2-bromophenyl)methyl]-SY104193

Database identifiers

CAS
91130-51-7
PubChem CID
2845477
DTXSID
DTXSID20385841
ChEMBL
CHEMBL4452645

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
12.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
171

Physicochemical properties

storage temp.
2 · Storage temp. 2-8°C
form
liquid
color
Colourless to light yellow
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302+H312+H332-H315-H319-H335
Precautionary statements
271 · P271-P280
Hazard Codes
Xi
Hazard Note
Irritant
HS Code
2934999090 · 2934999090

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

hs_code
2934999090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant
Hazard statements
H302+H312+H332-H315-H319-H335
Precautionary statements
P271-P280

Related reactions

1 records
New reaction record
HRID 737083 reaction equation
HRID 737083As reactantuspto-grants-2009_09

Compound notes

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