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2-Bromo-4-fluoro-5-methoxyaniline

HCID 22326666
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
420786-92-1
Standard SMILES
COc1cc(N)c(Br)cc1F
InChIKey
JRWKTSZPTRTXFS-UHFFFAOYSA-N
Molecular formula
C7H7BrFNO
Average molar mass
220.041 g/mol
Monoisotopic mass
218.96950416

Names & identifiers

Preferred name
2-Bromo-4-fluoro-5-methoxyaniline
IUPAC
2-Bromo-4-fluoro-5-methoxyaniline
English name
2-Bromo-4-fluoro-5-methoxyaniline
Molecular formula
C7H7BrFNO
Molecular weight
220.04

Names & synonyms

2-Bromo-4-fluoro-5-methoxyaniline6-Bromo-4-fluoro-3-methoxyaniline2-Bromo-4-fluoro-5-(methyloxy)aniline2-Bromo-4-fluoro-5-methoxy-phenylamineBenzenamine, 2-bromo-4-fluoro-5-methoxy-2-Bromo-4-fluoro-5-methoxyaniline ISO 9001:2015 REACH

Database identifiers

CAS
420786-92-1
PubChem CID
22326666
DTXSID
DTXSID90624835

Properties

Physicochemical properties

Boiling point
290.6 · 290.6±35.0℃ (760 Torr)
Density
1.616 · 1.616±0.06 g/cm3 (20 ºC 760 Torr)
Flash point
129.6 · 129.6±25.9℃
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
Appearance
Light brown to khaki Solid
InChI
InChI=1S/C7H7BrFNO/c1-11-7-3-6(10)4(8)2-5(7)9/h2-3H,10H2,1H3
InChIKey
JRWKTSZPTRTXFS-UHFFFAOYSA-N
SMILES
C1(N)=CC(OC)=C(F)C=C1Br
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
HS Code
2921410090 · 2921410090

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
2921410090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P301+P312-P302+P352-P304+P340-P305+P351+P338

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Related reactions

3 records
New reaction record
HRID 495437 reaction equation
HRID 495437As productuspto-grants-2005_09
HRID 495438 reaction equation
HRID 495438As reactantuspto-grants-2005_09
HRID 2319868 reaction equation
HRID 2319868As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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