3,5-Dinitro-4-chlorobenzotrifluoride

Modify Date: 2026-07-31 18:02:57

3,5-Dinitro-4-chlorobenzotrifluoride Structure
3,5-Dinitro-4-chlorobenzotrifluoride structure
Common Name 3,5-Dinitro-4-chlorobenzotrifluoride
CAS Number 393-75-9 Molecular Weight 270.550
Density 1.7±0.1 g/cm3 Boiling Point 278.6±35.0 °C at 760 mmHg
Molecular Formula C7H2ClF3N2O4 Melting Point 50-55 °C(lit.)
MSDS USA Flash Point 122.3±25.9 °C
Symbol GHS06
GHS06
Signal Word Danger

 Names

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

Name 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene
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 1.7±0.1 g/cm3
Boiling Point 278.6±35.0 °C at 760 mmHg
Melting Point 50-55 °C(lit.)
Molecular Formula C7H2ClF3N2O4
Molecular Weight 270.550
Flash Point 122.3±25.9 °C
Exact Mass 269.965515
PSA 91.64000
LogP 2.64
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.533
Stability Stable. Incompatible with strong oxidizing agents.

 MSDS

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

 Toxicological Information

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XS9065000
CHEMICAL NAME :
Toluene, 4-chloro-3,5-dinitro-alpha,alpha,alpha-trifluoro-
CAS REGISTRY NUMBER :
393-75-9
LAST UPDATED :
199801
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C7-H2-Cl-F3-N2-O4

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
930 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - ataxia Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
AISSAW Annali dell'Istituto Superiore di Sanita. (Istituto Poligrafico e Zecca dello Stato, Piazza Verdi, 10 Rome, Italy) V.1- 1965- Volume(issue)/page/year: 19,351,1983
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
161 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Olfaction) - effect, not otherwise specified Lungs, Thorax, or Respiration - dyspnea Gastrointestinal - hypermotility, diarrhea
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0546185 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
450 mg/kg/3D-I
TOXIC EFFECTS :
Blood - methemoglobinemia-carboxyhemoglobin Blood - changes in bone marrow (not otherwise specified)
REFERENCE :
EESADV Ecotoxicology and Environmental Safety. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1977- Volume(issue)/page/year: 17,21,1989
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2520 mg/kg/21D-C
TOXIC EFFECTS :
Liver - changes in liver weight Blood - normocytic anemia Blood - methemoglobinemia-carboxyhemoglobin
REFERENCE :
EESADV Ecotoxicology and Environmental Safety. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1977- Volume(issue)/page/year: 12,105,1986 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 0.05 mg/m3;Skin JAN 1993

 Safety Information

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

Symbol GHS06
GHS06
Signal Word Danger
Hazard Statements H302-H310
Precautionary Statements P280-P302 + P350-P310
Personal Protective Equipment Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges
Hazard Codes T,Xi
Risk Phrases R22:Harmful if swallowed. R24:Toxic in contact with skin. R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Phrases S36/37-S45
RIDADR UN 2811 6.1/PG 2
WGK Germany 3
RTECS XS9065000
Packaging Group II
Hazard Class 6.1
HS Code 2904909090

 Customs

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

HS Code 2904909090
Summary HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

 Articles13

More Articles

This table lists relevant public references with title, journal and publication metadata for this compound.

New procedure of selected biogenic amines determination in wine samples by HPLC.

Anal. Chim. Acta 834 , 58-66, (2014)

A new procedure for determination of biogenic amines (BA): histamine, phenethylamine, tyramine and tryptamine, based on the derivatization reaction with 2-chloro-1,3-dinitro-5-(trifluoromethyl)-benzen...

In vitro mutational studies with trifluralin and trifluorotoluene derivatives.

Ann. Ist. Super. Sanita 18(1) , 123-6, (1982)

[Acute oral toxicity in the rat of 3-nitro-4-chloro-alpha,alpha, alpha-trifluorotoluene (NCTT) and 3,5-dinitro-4-chloro-alpha,alpha, alpha-trifluorotoluene (DNCTT)].

Ann. Ist. Super. Sanita 19(2-3) , 351-4, (1983)

 3,5-Dinitro-4-chlorobenzotrifluorideBioassay

View more

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

Name: Cell Viability Profiling of Human Lymphoblast Cell Lines
Source: NCGC
Target: N/A
External Id: HAPV101
Name: Caspase-3/7 Activation Profiling of Human Lymphoblast Cell Lines
Source: NCGC
Target: N/A
External Id: HAPC101
Name: p53 small molecule agonists, cell-based qHTS assay
Source: 824
External Id: P53344
Name: p53 small molecule agonists, cell-based qHTS assay with human liver microsomes
Source: 824
Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS233
Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes
Source: 824
Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS898
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 Synonyms

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

4-chloro-3,5-dinitro-benzotrifluorid
2-chloro-1,3-dinitro-5-trifluoromethylbenzene
2,6-dinitro-4-trifluoromethyl-1-chlorobenzene
2-Chloro-1,3-dinitro-5-(trifluoromethyl)benzene
5-dinitrobenzotrifluoride
1,3-dinitro-2-chloro-5-trifluoromethylbenzene
1,3-Dinitro-2-chloro
EINECS 206-889-3
MFCD00007068
4-Chloro-3,5-dinitrobenzotrifluoride
2,6-dinitro-4-trifluoromethyl-chlorobenzene
4-trifluoromethyl-2,6-dinitrochlorobenzene
CDNT,DNT-Cl
DNT-CL
Chloralin
CDNT
CDNT DNT-Cl
4-chloro-3,5-dinitrotrifluoromethylbenzene
3,5-dinitro-4-chloro-α,α,α-trifluorotoluene
4-chloro-3,5-di
3,5-Dinitro-4-chlorobenzotrifluoride

 3,5-Dinitro-4-chlorobenzotrifluoride | FAQ

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

Q: What is the molecular weight of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: Molecular weight of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene is 270.550.
Q: What is the CAS number of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: CAS number of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene is 393-75-9.
Q: What is the English name of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: The English name of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene is 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene.
Q: What is the polar surface area (PSA) of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: Polar surface area (PSA) of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene is 91.64000.
Q: What is the safety information for 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: Safety information for 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene: S36/37-S45.
Q: What is the melting point of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: Melting point of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene is 50-55 °C(lit.).
Q: What are the upstream materials of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: Related upstream materials(CAS) of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene: 121-17-5;7664-93-9;98-56-6.
Q: What are the downstream products of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: Related downstream products(CAS) of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene: 349-57-5;393-77-1;131182-93-9;120-78-5;34207-44-8;368-53-6;454-73-9;33245-39-5;445-66-9.
Q: What is the boiling point of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: Boiling point of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene is 278.6±35.0 °C at 760 mmHg.
Q: What is the molecular formula of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene?
A: Molecular formula of 1,3-Dinitro-2-chloro-5-trifluoromethylbenzene is C7H2ClF3N2O4.

 3,5-Dinitro-4-chlorobenzotrifluoridefactory

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

Shanghai Nianxing Industrial Co., Ltd
Dayang Chem (Hangzhou) Co., Ltd.
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