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4-Bromo-N-ethyl-2-fluorobenzamide

HCID 24690701
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
749927-82-0
Standard SMILES
CCNC(=O)c1ccc(Br)cc1F
InChIKey
WRCAXTFEUQRZDZ-UHFFFAOYSA-N
Molecular formula
C9H9BrFNO
Average molar mass
246.08 g/mol
Monoisotopic mass
244.98515423

Names & identifiers

Preferred name
4-Bromo-N-ethyl-2-fluorobenzamide
IUPAC
4-bromo-N-ethyl-2-fluorobenzamide
English name
4-bromo-N-ethyl-2-fluorobenzamide
Molecular formula
C9H9BrFNO
Molecular weight
246.08

Names & synonyms

4-Bromo-N-ethyl-2-fluorobenzamide749927-82-0ETHYL 4-BROMO-2-FLUOROBENZAMIDEMFCD099288934-bromo-N-ethyl-2-fluoro-benzamideSCHEMBL3346723SCHEMBL29249951DTXSID50640738WRCAXTFEUQRZDZ-UHFFFAOYSA-N4-Bromo-2-fluoro-N-ethylbenzamideAKOS000167182SB77200
Show more names
Benzamide, 4-bromo-N-ethyl-2-fluoro-
BS-25951DB-370392

Database identifiers

CAS
749927-82-0
PubChem CID
24690701
DTXSID
DTXSID50640738

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
188

Physicochemical properties

storage temp.
2 · Sealed in dry,2-8°C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

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

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers7 total

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]

Related reactions

4 records
New reaction record
HRID 16111 reaction equation
HRID 16111As productuspto-grants-2010_06
HRID 1023802 reaction equation
HRID 1023802As productuspto-grants-2014_05
HRID 1205165 reaction equation
HRID 1205165As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1695155 reaction equation
HRID 1695155As productuspto-grants-2012_04

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes