Bentranil

Modify Date: 2026-07-01 23:35:32

Bentranil Structure
Bentranil structure
Common Name Bentranil
CAS Number 1022-46-4 Molecular Weight 223.22700
Density 1.23g/cm3 Boiling Point 189-192ºC8 mm Hg(lit.)
Molecular Formula C14H9NO2 Melting Point 123-125ºC(lit.)
MSDS Chinese USA Flash Point 163ºC
Symbol GHS07
GHS07
Signal Word Warning

 Use of Bentranil


Bentranil is pesticide agent.

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name bentranil
Synonym More Synonyms

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 1.23g/cm3
Boiling Point 189-192ºC8 mm Hg(lit.)
Melting Point 123-125ºC(lit.)
Molecular Formula C14H9NO2
Molecular Weight 223.22700
Flash Point 163ºC
Exact Mass 223.06300
PSA 43.10000
LogP 2.85500
Vapour Pressure 5.32E-05mmHg at 25°C
Index of Refraction 1.634
InChIKey HTTLBYITFHMYFK-UHFFFAOYSA-N
SMILES O=c1oc(-c2ccccc2)nc2ccccc12

 Safety Information

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases 26-37/39
RIDADR NONH for all modes of transport
WGK Germany 3
HS Code 2934999027

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

 Customs

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code 2934999027
Summary 2934999027 3-isopropyl-1h-benzo[c][1,2,6]thiadiazin-4(3h)-one 2,2-dioxide。supervision conditions:s(import or export registration certificate for pesticides)。VAT:17.0%。tax rebate rate:9.0%。MFN tarrif:6.5%。general tariff:20.0%

 BentranilBioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: Cell survival assay for modulators of telomere damage signalling
Source: 15378
Target: N/A
External Id: TELO_02
Name: In vitro inhibitory activity against human leukocyte elastase (HLE), at a concentrati...
Source: ChEMBL
Target: Neutrophil elastase
External Id: CHEMBL676210
Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
Name: Displacement of [3H]DPCPX from Sprague-Dawley rat whole brain membrane A1AR by scinti...
Source: ChEMBL
Target: Adenosine receptor A1
External Id: CHEMBL4625018
Name: In vitro inhibitory activity against human leukocyte elastase (HLE), at a concentrati...
Source: ChEMBL
Target: Neutrophil elastase
External Id: CHEMBL676209
Name: Displacement of [3H]NECA from Sprague-Dawley rat striatal membrane A2A adenosine rece...
Source: ChEMBL
Target: Adenosine receptor A2a
External Id: CHEMBL4625020
Name: In vitro inhibitory activity against human leukocyte elastase (HLE), at a concentrati...
Source: ChEMBL
Target: Neutrophil elastase
External Id: CHEMBL676211
Name: Inhibition of human leukocyte elastase
Source: ChEMBL
Target: Neutrophil elastase
External Id: CHEMBL858400
Name: Inhibition of recombinant Escherichia coli N-terminal His-tagged rhomboid protease Gl...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4188950
Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

4H-3,1-BENZOXAZIN-4-ONE,2-PHENYL
2-phenyl-3,1-benzoxazin-4-one
MFCD00043598
Bentranil
2-phenyl-1,2-dihydro-4H-3,1-benzoxazin-4-one
Linurotox
Linarotox
2-phenylbenzoxazinone
2-phenyl-4H-3,1-benzoxazin-4-one
H-170

 Bentranil | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the polar surface area (PSA) of bentranil?
A: Polar surface area (PSA) of bentranil is 43.10000.
Q: What are the downstream products of bentranil?
A: Related downstream products(CAS) of bentranil: 6484-25-9;579-93-1;30909-95-6;1022-45-3;148321-04-4;17240-30-1;123845-83-0;1904-60-5;18543-23-2;100-52-7.
Q: What is the LogP of bentranil?
A: LogP of bentranil is 2.85500.
Q: What is the melting point of bentranil?
A: Melting point of bentranil is 123-125ºC(lit.).
Q: What is the safety information for bentranil?
A: Safety information for bentranil: 26-37/39.
Q: What English synonyms does bentranil have?
A: English synonyms of bentranil: 4H-3,1-BENZOXAZIN-4-ONE,2-PHENYL, 2-phenyl-3,1-benzoxazin-4-one, MFCD00043598, Bentranil, 2-phenyl-1,2-dihydro-4H-3,1-benzoxazin-4-one, Linurotox, Linarotox, 2-phenylbenzoxazinone, 2-phenyl-4H-3,1-benzoxazin-4-one, H-170.
Q: What is the molecular weight of bentranil?
A: Molecular weight of bentranil is 223.22700.
Q: What are the upstream materials of bentranil?
A: Related upstream materials(CAS) of bentranil: 98-88-4;118-92-3;948-65-2;201230-82-2;615-43-0;31588-18-8;579-93-1;326903-42-8;70787-27-8;118-48-9.
Q: What are the uses of bentranil?
A: Main uses of bentranil: Bentranil is pesticide agent.
Q: What is the SMILES notation of bentranil?
A: SMILES notation of bentranil is O=c1oc(-c2ccccc2)nc2ccccc12.

 Bentranilfactory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd
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