2-Hydroxy-5-methylphenylboronic acid

CAT: 0127-OR360235Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR360235Size:1 g

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CAS Number

259209-21-7

MDL Number

MFCD09839105

Purity

97%

Smiles

Cc1ccc(O)c(c1)B(O)O

Chemical Information

(2-Hydroxy-5-methylphenyl)boronic acid

CAS Number	259209-21-7
PubChem CID	18617005
IUPAC Name	(2-hydroxy-5-methylphenyl)boronic acid
Molecular Formula	C7H9BO3
Molecular Weight	151.96
Topological Polar Surface Area	60.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	129

SMILES

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

InChI

InChI=1S/C7H9BO3/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4,9-11H,1H3

InChIKey

OJSKCZZLOSEKPH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 259209-21-7

CID: 18617005

Formula: C7H9BO3

MW: 151.96

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	151.96
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	152.0644743
Monoisotopic Mass	152.0644743
Topological Polar Surface Area	60.7 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	129
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
OR361261	5-Hydroxy-2-methylphenylboronic acid
OR361260-01	3-Hydroxy-5-methylphenylboronic acid
OR1084700-01	2-Hydroxy-6-methylphenylboronic acid
OR361259-01	2-Hydroxy-3-methylphenylboronic acid
OR471041-01	5- (2-Hydroxy-2-propyl) -2-methylphenylboronic acid pinacol ester
OR361262	3-Hydroxy-5-methylphenylboronic acid, pinacol ester
OR1095972	5- (Benzyloxy) -2-methylphenylboronic acid
OR1099643	5- (Methoxymethoxy) -2-methylphenylboronic acid
OR360252	2- (Methoxymethoxy) -5-methylphenylboronic acid
OR360647	2-Amino-5-methylphenylboronic acid

Catalog	Name
418284-01	2-Hydroxy-5-methylphenylboronic acid
AFC21645-01	5-Hydroxy-2-methylphenylboronic acid
425990-01	3-Hydroxy-5-methylphenylboronic acid
sc-259933A	2-Hydroxy-3-methylphenylboronic acid
418251-01	2-Hydroxy-4-methylphenylboronic acid
425991-01	3-Hydroxy-5-methylphenylboronic acid, pinacol ester
435499-01	5-Bromo-2-methylphenylboronic acid
416944-01	2-Chloro-5-methylphenylboronic acid
sc-299684A	5-Acetamido-2-methylphenylboronic acid
sc-256166	2-Isobutoxy-5-methylphenylboronic acid