2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

Basic Information

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CAS Number

1003575-43-6

Molecular Formula

C12H17BFNO2

Molecular Weight

237.08 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

54.0-55.1 ºC

SMILES

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CC1(C)OB(OC1(C)C)c2ccc(F)c(N)c2

InChI

InChI=1S/C12H17BFNO2/c1-11(2)12(3,4)17-13(16-11)8-5-6-9(14)10(15)7-8/h5-7H,15H2,1-4H3

InChIKey

VXNIVUKZNDRJBW-UHFFFAOYSA-N

LogP

1.7071

Topological Polar Surface Area

44.480000000000004 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

282

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

3-AMINO-4-FLUOROPHENYLBORONIC ACID, PINACOL ESTER
2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
2-Fluoro-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenylamine
3-Amino-4-fluorophenylboronic acid pinacol ester
3-Amino-4-fluorophenylboronic acid, pinacol ester, AldrichCPR
VXNIVUKZNDRJBW-UHFFFAOYSA-N
ZXBA000522
FCH2835652
AM86197
PC52054
MB09119
SY038295
BC000008
AX8228413
AB1007770
ST240222

MDL Number

MFCD11044430

Customs Code

2934999090

FAQ

What is 2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (CAS: 1003575-43-6)?

2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (CAS: 1003575-43-6) is a boronic acid derivative with a fluoro-substituted aniline core. It is used as an intermediate in organic synthesis and as a ligand in catalytic reactions.

What are the main uses of 2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (CAS: 1003575-43-6)?

2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (CAS: 1003575-43-6) is primarily used as a reagent in organic synthesis, particularly in the preparation of boronic acids and as a ligand in transition metal-catalyzed reactions.

Is 2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (CAS: 1003575-43-6) safe?

2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (CAS: 1003575-43-6) is considered safe when handled with proper precautions. It is important to wear appropriate personal protective equipment and ensure adequate ventilation. Avoid contact with skin and eyes, and store in a cool, dry place away from direct sunlight.

How should 2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (CAS: 1003575-43-6) be stored?

2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (CAS: 1003575-43-6) should be stored in a cool, dry place, away from direct sunlight and sources of ignition. Keep in a tightly sealed container to protect from moisture. Store below 25°C to maintain stability.