CAS 1734-79-8|2-Propenal, 3- (4-nitrophenyl)-

Introduction：Basic information about CAS 1734-79-8|2-Propenal, 3- (4-nitrophenyl)-, 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
4. Safety Information
5. Customs
6. Articles2
7. Synonyms

Common Name	2-Propenal, 3- (4-nitrophenyl)-
CAS Number	1734-79-8	Molecular Weight	177.157
Density	1.3±0.1 g/cm3	Boiling Point	311.6±17.0 °C at 760 mmHg
Molecular Formula	C₉H₇NO₃	Melting Point	140-143 °C(lit.)
MSDS	ChineseUSA	Flash Point	151.6±13.7 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	3-(4-Nitrophenyl)acrylaldehyde
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.3±0.1 g/cm3
Boiling Point	311.6±17.0 °C at 760 mmHg
Melting Point	140-143 °C(lit.)
Molecular Formula	C₉H₇NO₃
Molecular Weight	177.157
Flash Point	151.6±13.7 °C
Exact Mass	177.042587
PSA	62.89000
LogP	1.90
Vapour Pressure	0.0±0.7 mmHg at 25°C
Index of Refraction	1.618
InChIKey	ALGQVMMYDWQDEC-OWOJBTEDSA-N
SMILES	O=CC=Cc1ccc([N+](=O)[O-])cc1
Storage condition	Refrigerator (+4°C)

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GD6650000

CHEMICAL NAME :: Cinnamaldehyde, p-nitro-

CAS REGISTRY NUMBER :: 1734-79-8

BEILSTEIN REFERENCE NO. :: 1565424

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C9-H7-N-O3

MOLECULAR WEIGHT :: 177.17

WISWESSER LINE NOTATION :: WNR D1U1VH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 500 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Behavioral - changes in motor activity (specific assay)

REFERENCE :: CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,145,1954

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H315-H319
Precautionary Statements	P305 + P351 + P338
Hazard Codes	Xi:Irritant
Risk Phrases	R36/38
Safety Phrases	S26-S36
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	GD6650000
HS Code	2913000090

Customs

HS Code	2913000090
Summary	HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%

Articles2

Reactivity at the substrate activation site of yeast pyruvate decarboxylase: inhibition by distortion of domain interactions.

Biochemistry 37(5) , 1245-55, (1998)

The residue C221 on pyruvate decarboxylase (EC. 4.1.1.1) from Saccharomyces cerevisiae has been shown to be the site where the substrate activation cascade is triggered [Baburina et al. (1994) Biochem...

Genotoxicity of p-nitrocinnamaldehyde and related alpha, beta-unsaturated carbonyl compounds in two bacterial assays.

Mutagenesis 6(4) , 261-9, (1991)

Seventeen cinnamaldehydes, cinnamic acids, 2-furylacroleins and related compounds were tested in the Salmonella preincubation reversion assay and in the SOS chromotest. Of eight compounds containing n...

Synonyms

MFCD00007379

2-Propenal, 3- (4-nitrophenyl)-

3-(4-Nitrophenyl)-2-propenal

(2E)-3-(4-Nitrophenyl)acrylaldehyde

2-Propenal, 3-(4-nitrophenyl)-, (2E)-

(2E)-3-(4-Nitrophenyl)-2-propenal

4-NITROCINNAMALDEHYDE

trans-4-Nitrocinnamaldehyde

EINECS 217-076-8

Recommended......