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Carbamicacid, N-[6-(phenylthio)-1H-benzimidazol-2-yl]-, methyl ester(CAS No. 43210-67-9)

Carbamicacid, N-[6-(phenylthio)-1H-benzimidazol-2-yl]-, methyl ester C15H13N3O2S (cas 43210-67-9) Molecular Structure

43210-67-9 Structure

Identification and Related Records

【Name】
Carbamicacid, N-[6-(phenylthio)-1H-benzimidazol-2-yl]-, methyl ester
【Iupac name】
methyl N-(6-phenylsulfanyl-1H-benzimidazol-2-yl)carbamate
【CAS Registry number】
43210-67-9
【Synonyms】
Carbamicacid, [5-(phenylthio)-1H-benzimidazol-2-yl]-, methyl ester (9CI)
2-(Methoxycarbonylamino)-5-(phenylthio)benzimidazole
Axilur
Fenbendazol
Fenbion
HOE 881
Methyl5-(phenylthio)-2-benzimidazolecarbamate
Methyl[5-(phenylthio)-1H-benzimidazol-2-yl]carbamate
Panacur
Safe-Guard
【EINECS(EC#)】
256-145-7
【Molecular Formula】
C15H13N3O2S (Products with the same molecular formula)
【Molecular Weight】
299.34762
【Inchi】
InChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
【InChIKey】
HDDSHPAODJUKPD-UHFFFAOYSA-N
【Canonical SMILES】
COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC=C3
【MOL File】
43210-67-9.mol

Chemical and Physical Properties

【Appearance】
white to yellowish powder
【Density】
1.4 g/cm3
【Melting Point】
233℃
【Boiling Point】
°Cat760mmHg
【Refractive Index】
1.709
【Flash Point】
°C
【Water】
Insoluble
【Solubilities】
Insoluble Appearance:white to yellowish powder
Transport Information:HAZARD
Hazard Symbols:UN NO.
Deleted CAS:53571-02-1
【Stability】
Stable at normal temperatures and pressures.
【Storage temp】
0-6°C
【Computed Properties】
Molecular Weight:299.34762 [g/mol]
Molecular Formula:C15H13N3O2S
XLogP3:3.6
H-Bond Donor:2
H-Bond Acceptor:3
Rotatable Bond Count:4
Tautomer Count:5
Exact Mass:299.072847
MonoIsotopic Mass:299.072847
Topological Polar Surface Area:92.3
Heavy Atom Count:21
Formal Charge:0
Complexity:363
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
Feature 3D Acceptor Count:1
Feature 3D Donor Count:2
Feature 3D Ring Count:3
Effective Rotor Count:5
Conformer Sampling RMSD:0.8
CID Conformer Count:20

Safety and Handling

【Hazard Codes】
UN NO.
【Risk Statements】
R36/37/38
【Safety Statements 】
26-36
【Safety】
Hazard Codes:Xi
Risk Statements:36/37/38
36/37/38:Irritating to eyes, respiratory system and skin
Safety Statements:26-36
26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36:Wear suitable protective clothing
WGK Germany:2
【Transport】
HAZARD
【Specification】

Off-White Solid
usageEng:An anthelmintic (Nematodes)
Safety Statements:26-36
26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36:Wear suitable protective clothing

Use and Manufacturing

【Usage】

An anthelmintic (Nematodes)

Biomedical Effects and Toxicity

【Pharmacological Action】
- Substances used in the treatment or control of nematode infestations. They are used also in veterinary practice.
【Therapeutic Uses】
An anthelmintic (Nematodes)

Supplier Location

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Business Type:Trading Company
Telephone:86-153-73023168
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Telephone:86-312-18103315327
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Telephone:86-571-87396430

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