2-Anthraceneboronic Acid

CAT: 0024-sc-472484Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-472484Size:250 mg

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CAS Number

141981-64-8

Chemical Information

2-Anthraceneboronic Acid (contains varying amounts of Anhydride)

CAS Number	141981-64-8
PubChem CID	9855952
IUPAC Name	anthracen-2-ylboronic acid
Molecular Formula	C14H11BO2
Molecular Weight	222.05
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	17
Formal Charge	0
Complexity	269

SMILES

B(C1=CC2=CC3=CC=CC=C3C=C2C=C1)(O)O

InChI

InChI=1S/C14H11BO2/c16-15(17)14-6-5-12-7-10-3-1-2-4-11(10)8-13(12)9-14/h1-9,16-17H

InChIKey

PKWBMOXZIMVOJT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 141981-64-8

CID: 9855952

Formula: C14H11BO2

MW: 222.05

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	222.05
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	222.0852098
Monoisotopic Mass	222.0852098
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	269
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
sc-227137	9-Anthraceneboronic acid
sc-283301	2,2-Dimethylnonanoic Acid
sc-230702	2,2-Difluorobutyric acid
sc-275212	2,2-Dimethylhexanoic acid
sc-283301A	2,2-Dimethylnonanoic Acid
sc-230711	2,2-Dimethylbutyric acid
sc-265935	2,2-Difluorosuccinic acid
sc-225563	2,2-Dimethylvaleric acid
sc-497119	2,2-Diphenylhydantoic Acid
sc-288344	2,2-Dimethylethenylboronic acid

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