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5-Amino-2-fluorophenylboronic acid

HCID 4683192
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Basic information

CAS
873566-74-6
Standard SMILES
Nc1ccc(F)c(B(O)O)c1
InChIKey
CDZMVORRMKESPD-UHFFFAOYSA-N
Molecular formula
C6H7BFNO2
Average molar mass
154.94 g/mol
Monoisotopic mass
155.0553868

Names & identifiers

Preferred name
5-Amino-2-fluorophenylboronic acid
IUPAC
(5-amino-2-fluorophenyl)boronic acid
English name
5-AMINO-2-FLUOROPHENYLBORONIC ACID
Molecular formula
C6H7BFNO2
Molecular weight
154.93

Names & synonyms

873566-74-65-AMINO-2-FLUOROPHENYLBORONIC ACIDDTXSID50405526RefChem:300969DTXCID20356379(5-amino-2-fluorophenyl)boronic acidMFCD03411555(5-amino-2-fluoro-phenyl)boronic Acid2-fluoro-5-aminophenylboronic acidBoronic acid, (5-amino-2-fluorophenyl)-SCHEMBL2786252SCHEMBL29517809
Show more names
BORONIC ACID,B-(5-AMINO-2-FLUOROPHENYL)-
(5-amino-2-fluorophenyl)boronicacidAKOS006333033AT21959BS-22556SY470519CS-0174872EN300-2991191

Database identifiers

CAS
873566-74-6
PubChem CID
4683192
DTXSID
DTXSID50405526
Nikkaji
J2.353.933K

Properties

Computed structural properties

Topological polar surface area
66.5 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
136

Physicochemical properties

storage temp.
2 · 2-8°C
Appearance
gray powder
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-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
P261-P305+P351+P338

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Compound notes

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