CAS 1222-98-6|(2E)-3-(4-Nitrophenyl)-1-phenyl-2-propen-1-one

Introduction：Basic information about CAS 1222-98-6|(2E)-3-(4-Nitrophenyl)-1-phenyl-2-propen-1-one, 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. Articles2
7. Synonyms

Common Name	(2E)-3-(4-Nitrophenyl)-1-phenyl-2-propen-1-one
CAS Number	1222-98-6	Molecular Weight	253.253
Density	1.3±0.1 g/cm3	Boiling Point	399.2±34.0 °C at 760 mmHg
Molecular Formula	C₁₅H₁₁NO₃	Melting Point	158-160 °C(lit.)
MSDS	ChineseUSA	Flash Point	186.5±18.5 °C

Names

Name	4-nitrochalcone
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.3±0.1 g/cm3
Boiling Point	399.2±34.0 °C at 760 mmHg
Melting Point	158-160 °C(lit.)
Molecular Formula	C₁₅H₁₁NO₃
Molecular Weight	253.253
Flash Point	186.5±18.5 °C
Exact Mass	253.073898
PSA	62.89000
LogP	3.79
Vapour Pressure	0.0±0.9 mmHg at 25°C
Index of Refraction	1.651

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: FL7075500

CHEMICAL NAME :: Chalcone, 4-nitro-

CAS REGISTRY NUMBER :: 1222-98-6

BEILSTEIN REFERENCE NO. :: 0400543

LAST UPDATED :: 199701

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C15-H11-N-O3

MOLECULAR WEIGHT :: 253.27

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >3 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :: Mutation in microorganisms

TEST SYSTEM :: Bacteria - Salmonella typhimurium

DOSE/DURATION :: 10 ug/plate

REFERENCE :: MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 188,267,1987

Safety Information

Personal Protective Equipment	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes	Xi
Safety Phrases	S24/25
RIDADR	NONH for all modes of transport
WGK Germany	2
RTECS	FL7075500
HS Code	2914700090

Customs

HS Code	2914700090
Summary	HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

Articles2

Structure-mutagenicity relationships of chalcones and their oxides in the Salmonella assay.

Mutat. Res. 169(3) , 71-9, (1986)

31 p-monosubstituted chalcones (E-1, 3-diphenylpropene-1-one) and the corresponding oxides (E-1-benzoyl-2-phenyloxirane) were tested for mutagenic activity on two strains of Salmonella typhimurium (TA...

Synthesis and Photochromic Properties of New Heterocyclic Derivatives of 1, 3-Diazabicyclo [3.1. 0] Hex-3-Ene. Mahmoodi NO, et al.

J. Chin. Chem. Soc. 54(3) , 635-41, (2007)

Synonyms

4-Nitrochalcone 25GR

EINECS 214-949-5

4-nitrocalone

trans-4-Nitrochalcone

4-Nitrochalcone

p-nitrobenzylideneacetophenone

2-(4-Nitrobenzylidene)acetophenone

4-Nitrostyrylphenyl ketone

4-NITROBENZYLIDENEACETOPHENONE

2-Propen-1-one, 3-(4-nitrophenyl)-1-phenyl-, (2E)-

(2E)-3-(4-Nitrophenyl)-1-phenyl-2-propen-1-one

4'-nitrochalcone

MFCD00007382

4-nitro-chalcon

(2E)-3-(4-Nitrophenyl)-1-phenylprop-2-en-1-one

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