3,5-Dichlorophenylboronic acid, pinacol ester

CAT: 0926-TCA71651-01Size: 0.25 gDry Ice: NoHazardous: No

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CAT#:0926-TCA71651-01Size:0.25 g

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CAS Number

68716-51-8

MDL Number

MFCD05863906

Smiles

B1 (OC (C (O1) (C) C) (C) C) C2=CC (=CC (=C2) Cl) Cl

Molecular Formula

C12H15BCl2O2

Molecular Weight

272.96 g/mol

Controlled

Chemical Information

2-(3,5-Dichlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS Number	68716-51-8
PubChem CID	2758200
IUPAC Name	2-(3,5-dichlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Molecular Formula	C12H15BCl2O2
Molecular Weight	273.0
Topological Polar Surface Area	18.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	17
Formal Charge	0
Complexity	270

SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C12H15BCl2O2/c1-11(2)12(3,4)17-13(16-11)8-5-9(14)7-10(15)6-8/h5-7H,1-4H3

InChIKey

HKSNHZBPIBSVGI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 68716-51-8

CID: 2758200

Formula: C12H15BCl2O2

MW: 273.0

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	273.0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	272.0542153
Monoisotopic Mass	272.0542153
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	270
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

Catalog	Name
BRA79702	3,4-Dichlorophenylboronic acid pinacol ester
FA42855-01	3-Amino-5-nitrophenylboronic acid pinacol ester
EUA41193	3-Methoxy-5-trifluoromethylphenylboronic acid pinacol ester
YIB09329	5-Formylpyridine-3-boronic acid pinacol ester
CVD60796	3- (Hydroxymethyl) -5-methylphenylboronic acid pinacol ester
CTA97213-01	5-Bromo-3-pyridineboronic acid pinacol ester
CAB52587-01	3- (Trifluoromethyl) -5-fluorophenylboronic acid pinacol ester
INC28647	3-Fluoro-5-methylbenzeneboronic acid pinacol ester
SMB06995	3,4,5-Trichlorophenylboronic acid pinacol ester
YSB35499-01	5-Aminopyridine-3-boronic acid, pinacol ester

Catalog	Name
427345-01	3,5-Dichlorophenylboronic acid, pinacol ester
sc-310877A	3,4-Dichlorophenylboronic acid, pinacol ester
426972-01	3,4-Dichlorophenylboronic Acid Pinacol Ester
OR1083084-01	4-Amino-3,5-dichlorophenylboronic acid, pinacol ester
OR1087343	4-Benzyloxy-3,5-dichlorophenylboronic acid pinacol ester
OR1087428	3-Bromo-2,5-dichlorophenylboronic acid pinacol ester
OR361114-01	2,4-Dichlorophenylboronic acid, pinacol ester
OR1005354-01	2,6-Dichlorophenylboronic acid pinacol ester
414082	2- (Bromomethyl) -3,4-dichlorophenylboronic Acid Pinacol Ester
OR1097501	6-Bromo-2,3-dichlorophenylboronic acid pinacol ester