4-Boronobenzoic acid

CAT: 0931-TYD-00622-01Size: 10 gDry Ice: NoHazardous: No

1 / 1

CAT#:0931-TYD-00622-01Size:10 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

14047-29-1

Bioactivity

4-Boronobenzoic acid is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.

Smiles

O=C(C1=CC=C(B(O)O)C=C1)O

Molecular Formula

C7H7BO4

Molecular Weight

165.939

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

4-Carboxyphenylboronic Acid

CAS Number	14047-29-1
PubChem CID	312183
IUPAC Name	4-boronobenzoic acid
Molecular Formula	C7H7BO4
Molecular Weight	165.94
Topological Polar Surface Area	77.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	163

SMILES

B(C1=CC=C(C=C1)C(=O)O)(O)O

InChI

InChI=1S/C7H7BO4/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4,11-12H,(H,9,10)

InChIKey

SIAVMDKGVRXFAX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 14047-29-1

CID: 312183

Formula: C7H7BO4

MW: 165.94

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	165.94
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	166.0437389
Monoisotopic Mass	166.0437389
Topological Polar Surface Area	77.8 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	163
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
TYD-00307-01	4,4'-Bibenzoic acid
TYD-01189-01	4-Fluorohippuric acid
TN9187-01	4-Acetylbutyric acid
TYD-00617-01	4-Methoxyphenylboronic acid
TYD-00571-01	4-Benzyloxyphenylboronic acid
TYD-00460-01	4-Cyanobenzeneboronic acid
TYD-00419-01	4-Isopropoxyphenylboronic acid
TYD-00356-01	4-Propylphenylboronic acid
TYD-00193-01	4-Bromopicolinic acid
TN6662	4-Acetoxycinnamic acid

Alternative Products

Catalog	Name
HY-75102-01	4-Boronobenzoic acid
RG-B151802-01	3-Boronobenzoic Acid
sc-288889A	3-Acetamido-5-boronobenzoic acid
M2952-64	4-Mercaptophenylbutyric Acid (4- (4-Mercaptophenyl) butyric Acid)
MBS6028591-01	4-Mercaptophenylbutyric Acid (4-(4-Mercaptophenyl)butyric Acid)
sc-277680	4,4,4-Trichlorobutyric acid
PC3392-01	4,4,4-Trifluorocrotonic acid
OR73423-01	4,4',4''-Nitrilotribenzoic acid
sc-262191	4,4,4-Trifluorobutyric acid
PC7292-01	4,4,4-Trifluorobutanoic acid

4-Boronobenzoic acid

Chemical Information

Related Products

Alternative Products

Popular Products