5-Hydroxythiabendazole

CAT: 1596-AR-T01798-01Size: 250 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T01798-01Size:250 Units

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CAS Number

948-71-0

Synonyms

2- (thiazol-4-yl) -1H-benzo[d]imidazol-6-ol; 2- (4-Thiazolyl) -1H-benzimidazol-6-ol; 5-Hydroxythiabendazole

Molecular Formula

C10H7N3OS

Molecular Weight

217.25

API Name

Thiabendazole

Chemical Information

5-Hydroxythiabendazole

5-Hydroxythiabendazole is a member of benzimidazoles.

CAS Number	948-71-0
PubChem CID	108227
IUPAC Name	2-(1,3-thiazol-4-yl)-3H-benzimidazol-5-ol
Molecular Formula	C10H7N3OS
Molecular Weight	217.25
XLogP	2.1
Topological Polar Surface Area	90
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	15
Formal Charge	0
Complexity	241

SMILES

C1=CC2=C(C=C1O)NC(=N2)C3=CSC=N3

InChI

InChI=1S/C10H7N3OS/c14-6-1-2-7-8(3-6)13-10(12-7)9-4-15-5-11-9/h1-5,14H,(H,12,13)

InChIKey

VNENJHUOPQAPAT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 948-71-0

CID: 108227

Formula: C10H7N3OS

MW: 217.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	217.25
XLogP3	2.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	217.03098303
Monoisotopic Mass	217.03098303
Topological Polar Surface Area	90 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	241
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
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AR-U01401-01	5-Azidouridine-5'-triphosphate
AR-L01111-01	Lamotrigine 5-5 Dimer
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AR-C03970-01	5-Azacytidine 5'-monophosphate
AR-M01927-01	5-Decyano 5-Carboxymilrinone
AR-B02000-01	5-Desbromo, 5-Chloro Brimonidine
AR-H07318-01	5,5-Diphenyl Hydantoin Sodium

Catalog	Name
HY-116787-01	5-Hydroxythiabendazole
HY-116787R	5-Hydroxythiabendazole (Standard)
sc-262725	5,5,5-Trifluorovaleronitrile
234404-01	5,5,5-Trifluoronorvaline
PDA86661	5,5,5-Trifluoropentanonitrile
JH238299	5,5,5-trifluoroleucine
AKA25347-01	5,5,5-Trifluoropentanal
TRC-F632600-2.5G	N-Fmoc-5,5,5,5',5',5'-Hexafluoro-L-leucine
OR1058406-01	5,5',5'',5'''-Methanetetrayltetrakis (2-hydroxybenzaldehyde)
459053	N-Fmoc-5,5,5,5',5',5'-Hexafluoro-L-leucine discontinued