4-(4-Nitrobenzyl)morpholine

HCID 783183
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Basic information

CAS
6425-46-3
Standard SMILES
O=[N+]([O-])c1ccc(CN2CCOCC2)cc1
InChIKey
KNTGXGBOYZAKTA-UHFFFAOYSA-N
Molecular formula
C11H14N2O3
Average molar mass
222.24 g/mol
Monoisotopic mass
222.10044231

Names & identifiers

Preferred name
4-(4-Nitrobenzyl)morpholine
IUPAC
4-[(4-nitrophenyl)methyl]morpholine
English name
4-(4-Nitrobenzyl)morpholine
Molecular formula
C11H14N2O3
Molecular weight
222.24

Names & synonyms

4-(4-nitrobenzyl)morpholine6425-46-3DTXSID80354811RefChem:288204DTXCID103058714-[(4-nitrophenyl)methyl]morpholine4-(4-Nitro-benzyl)-morpholineMFCD004486294-(4-nitrobenzyl)-morpholineMorpholine, 4-[(4-nitrophenyl)methyl]-Cambridge id 5427782Oprea1_190765
Show more names
BUTTPARK 96\57-674-(4-Nitrobenzyl)morpholine,97%4-(4-NITROBENZYL)MORPHOLINE 95%4-[(4-nitrophenyl)methyl]morpholin-4-ium
Oprea1_765109SCHEMBL445885KNTGXGBOYZAKTA-UHFFFAOYSA-NALBB-023297SBB017296STL2868334-[(4-nitrophenyl)-methyl]morpholineAKOS000605739

Database identifiers

CAS
6425-46-3
PubChem CID
783183
DTXSID
DTXSID80354811
Nikkaji
J3.289.557C

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
58.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
16

Physicochemical properties

Melting point
79.6 · 79.6-80 °C
Boiling point
349.4 · 349.4±27.0 °C(Predicted)
Density
1.243 · 1.243±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
pka
5.82 · 5.82±0.10(Predicted)
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety data

hs_code
2933399990
risk_code
34
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
C
safety_code
36/37/39-26-22

Chemistry & industry

Upstream & downstream products

Suppliers42 total

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
Aladdin Scientific[email protected]

Related reactions

33 records
New reaction record

Compound notes

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