CAS 364-74-9|2,5-Difluoronitrobenzene

Introduction：Basic information about CAS 364-74-9|2,5-Difluoronitrobenzene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
MUTATION DATA
4. Safety Information
5. Customs
6. Articles6
7. Synonyms

Common Name	2,5-Difluoronitrobenzene
CAS Number	364-74-9	Molecular Weight	159.090
Density	1.5±0.1 g/cm3	Boiling Point	206.5±0.0 °C at 760 mmHg
Molecular Formula	C₆H₃F₂NO₂	Melting Point	−11.7 °C(lit.)
MSDS	ChineseUSA	Flash Point	90.0±0.0 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	2,5-Difluoronitrobenzene
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.5±0.1 g/cm3
Boiling Point	206.5±0.0 °C at 760 mmHg
Melting Point	−11.7 °C(lit.)
Molecular Formula	C₆H₃F₂NO₂
Molecular Weight	159.090
Flash Point	90.0±0.0 °C
Exact Mass	159.013184
PSA	45.82000
LogP	1.71
Vapour Pressure	0.3±0.3 mmHg at 25°C
Index of Refraction	1.510
InChIKey	XNJAYQHWXYJBBD-UHFFFAOYSA-N
SMILES	O=[N+]([O-])c1cc(F)ccc1F
Water Solubility	insoluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CZ5715000

CHEMICAL NAME :: Benzene, 1,4-difluoro-2-nitro-

CAS REGISTRY NUMBER :: 364-74-9

BEILSTEIN REFERENCE NO. :: 2210200

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C6-H3-F2-N-O2

MOLECULAR WEIGHT :: 159.10

WISWESSER LINE NOTATION :: WNR BF EF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :: Mutation in microorganisms

TEST SYSTEM :: Bacteria - Salmonella typhimurium

DOSE/DURATION :: 160 nL/plate

REFERENCE :: MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 116,217,1983

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes	Xi:Irritant;
Risk Phrases	R36/37/38
Safety Phrases	S26-S36
RIDADR	2810
WGK Germany	3
RTECS	CZ5715000
Packaging Group	III
Hazard Class	6.1
HS Code	2904909090

Customs

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%

Articles6

A combined experimental and computational thermodynamic study of difluoronitrobenzene isomers.

J. Phys. Chem. B 114(40) , 12914-25, (2010)

This work reports the experimental and computational thermochemical study performed on three difluorinated nitrobenzene isomers: 2,4-difluoronitrobenzene (2,4-DFNB), 2,5-difluoronitrobenzene (2,5-DFNB...

Different metabolic pathways of 2,5-difluoronitrobenzene and 2,5-difluoroaminobenzene compared to molecular orbital substrate characteristics.

Chem. Biol. Interact. 94(1) , 49-72, (1995)

The in vivo metabolite patterns of 2,5-difluoroaminobenzene and of its nitrobenzene analogue, 2,5-difluoronitrobenzene, were determined using 19F NMR analysis of urine samples. Results obtained demons...

In vitro metabolism of 5-fluoro-2-glutathionyl-nitrobenzene by kidney proximal tubular cells studied by 19F-NMR.

Chem. Biol. Interact. 98(2) , 97-112, (1995)

Proximal tubular biotransformation of the glutathionyl (GSH) conjugate derived from 2,5-difluoronitrobenzene (5-fluoro-2-glutathionyl-nitrobenzene) was studied by means of 19F-NMR. This method allows ...

Synonyms

2,5-Difluoro-1-nitrobenzene

1,4-Difluoro-2-nitrobenzene

2,5-Difluoronitroben

Benzene, 1,4-difluoro-2-nitro-

3,5-diflurobenzalcohol

EINECS 206-663-4

2,5-difluoronitro-benzene

1,4-difluoro-2-nitro-benzen

1-Nitro-2,5-difluorobenzene

2,5-Difluoronitrobenzene

2,4-DIFLUOROCINNAMIC ACD

MFCD00007054

1-fluoro-2-nitro-4-fluorobenzene

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