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Tridiphane

HCID 73669
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
58138-08-2
Standard SMILES
Clc1cc(Cl)cc(C2(CC(Cl)(Cl)Cl)CO2)c1
InChIKey
IBZHOAONZVJLOB-UHFFFAOYSA-N
Molecular formula
C10H7Cl5O
Average molar mass
320.4 g/mol
Monoisotopic mass
317.893953

Overview

Tridiphane is a dichlorobenzene.

Names & identifiers

Preferred name
Tridiphane
IUPAC
2-(3,5-dichlorophenyl)-2-(2,2,2-trichloroethyl)oxirane
English name
Tridiphane
Molecular formula
C10H7Cl5O
Molecular weight
320.43

Names & synonyms

Tridiphane58138-08-2NelponDowco 3562-(3,5-Dichlorophenyl)-2-(2,2,2-trichloroethyl)oxiraneZ5677LQE6JDTXSID8024365Oxirane, 2-(3,5-dichlorophenyl)-2-(2,2,2-trichloroethyl)-RefChem:191466DTXCID804365856-626-7(RS)-2-(3,5-Dichlorophenyl)-2-(2,2,2-trichloroethyl)oxirane
Show more names
Tandemdowco356TridiphanTridiphane solutionC17823000 TridiphaneTridiphane Solution, 100ppmTridiphane 10 μg/mL in Isooctane
(.+/-.)-2-(3,5-Dichlorophenyl)-2-(2,2,2-trichloroethyl)oxiraneTridiphane [ANSI:BSI:ISO]EPA Pesticide Chemical Code 123901UNII-Z5677LQE6JIBZHOAONZVJLOB-UHFFFAOYSA-NTRIDIPHANE [MI]TRIDIPHANE [ISO]SCHEMBL54378

Database identifiers

CAS
58138-08-2
PubChem CID
73669
DTXSID
DTXSID8024365
ChEBI
CHEBI:82251
UNII
Z5677LQE6J
EC Number
856-626-7
Nikkaji
J126.285H

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
12.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
256

Experimental & physicochemical properties

SpringerMaterials PropertiesFusion temperature
Pesticides · 4 items

Pesticide -> EPA IRIS

Herbicides

Active substance -> EU Pesticides database: Not approved

Pesticide (Tridiphane) -> USDA PDB

LogP4.34

Physicochemical properties

Melting point
42.8 °C · 42.8°C
Boiling point
435.99 °C · 435.99°C (rough estimate)
Density
1.5772 · 1.5772 (rough estimate)
refractive index
25 · nD25 1.5720
Henry's Law Constant
1.9 · 1.9×10-1 mol/(m3Pa) at 25℃, MacBean (2012)
FDA UNII
5677 LQE6J · Z5677LQE6J
Pesticides Freedom of Information Act (FOIA)
Tridiphane
EPA Substance Registry System
Tridiphane (58138-08-2)
Symbol(GHS)
7 · GHS07,GHS08,GHS09
Signal word
Warning
Hazard statements
302 · H302-H410
Precautionary statements
273 · P273-P391-P501-P264-P270-P301+P312-P330-P501
RIDADR
1325 · 1325
HazardClass
4.1 · 4.1
PackingGroup
III
HS Code
29109000 · 29109000
Toxicity
50 for · LD50 for technical grade (89-91% pure) in male, female mice, male, female rats (mg/kg): ~1200, ~740, 1700-2300, 1500-1900 orally (Hanley)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information2002/2076
Hazard Classes and CategoriesAcute Tox. 4 (100%)

Toxicology

Target OrgansReproductive
EPA IRIS Information · 3 items

Tridiphane

Reproductive

3 x 10 ^-3 mg/kg-day

RAIS Toxicity Values · 2 items

0.003

IRIS Current

Hazard Quotient Level 0.1 or Cancer Risk Level 1E-06 · 6 items

1.90e+02

2.50e+03

1.80e+01

5.00e+01

1.30e-01

3.00e-03

Hazard Quotient Level 3 or Cancer Risk Level 1E-04 · 6 items

5.70e+02

7.40e+03

5.40e+01

5.00e+01

3.00e-03

Volatile

Safety data

ridadr
1325
hs_code
29109000
Toxicity
LD50 for technical grade (89-91% pure) in male, female mice, male, female rats (mg/kg): ~1200, ~740, 1700-2300, 1500-1900 orally (Hanley)
Signal word
Warning
Symbol(GHS)
GHS07,GHS08,GHS09
hazard_class
4.1
packing_group
III
Hazard statements
H302-H410
Precautionary statements
P273-P391-P501-P264-P270-P301+P312-P330-P501

Chemistry & industry

Applications

UsesHerbicide.

Suppliers18 total

梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海毕楷科技有限公司18516304666 · [email protected]
天津阿尔塔科技有限公司022-65378550-8551 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
南通市苏北化工原料有限公司0513-85290972 18762756250 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
上海泰坦科技股份有限公司13023226327 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
上海安谱实验科技股份有限公司18502138905 · [email protected]
上海杰股生物科技有限公司021-51698675 · [email protected]
南通众合化工新材料有限公司0513-85666561 15950816326 · [email protected]

Additional notes

DefinitionChEBI: Tridiphane is a dichlorobenzene.

Related reactions

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Compound notes

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