5-Methyl-2-thienylboronic acid

CAT: 0024-sc-239061Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-239061Size:1 g

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CAS Number

162607-20-7

Chemical Information

(5-Methylthiophen-2-yl)boronic acid

CAS Number	162607-20-7
PubChem CID	2734374
IUPAC Name	(5-methylthiophen-2-yl)boronic acid
Molecular Formula	C5H7BO2S
Molecular Weight	141.99
Topological Polar Surface Area	68.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	99

SMILES

B(C1=CC=C(S1)C)(O)O

InChI

InChI=1S/C5H7BO2S/c1-4-2-3-5(9-4)6(7)8/h2-3,7-8H,1H3

InChIKey

NRIYPIBRPGAWDD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 162607-20-7

CID: 2734374

Formula: C5H7BO2S

MW: 141.99

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	141.99
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	142.0259808
Monoisotopic Mass	142.0259808
Topological Polar Surface Area	68.7 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	99
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
419196-01	2-Thienylboronic Acid
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abx186007-01	3-Formyl-2-thienylboronic acid
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