1,3-Diphenyl-2-propen-1-one

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Names

[ CAS No. ]:
94-41-7

[ Name ]:
1,3-Diphenyl-2-propen-1-one

[Synonym ]:
EINECS 202-330-2
BENZALACETOPHENONE
benzylidene acetophenone
CHALKONE
MFCD00003082
Cinnamophenone
CHALCONE
PhCOCH=CHPh
styrylphenylketone

Chemical & Physical Properties

[ Boiling Point ]:
208 °C25 mm Hg(lit.)

[ Melting Point ]:
55-59 °C

[ Molecular Formula ]:
C15H12O

[ Molecular Weight ]:
208.25500

[ Flash Point ]:
>230 °F

[ Exact Mass ]:
208.08900

[ PSA ]:
17.07000

[ LogP ]:
3.58270

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
FL6900000
CHEMICAL NAME :
Chalcone
CAS REGISTRY NUMBER :
94-41-7
LAST UPDATED :
199706
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C15-H12-O
MOLECULAR WEIGHT :
208.27
WISWESSER LINE NOTATION :
RV1U1R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
681 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Rodent - mouse Cells - not otherwise specified
DOSE/DURATION :
250 units/L
REFERENCE :
ECREAL Experimental Cell Research. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.10- 1950- Volume(issue)/page/year: 35,629,1964

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn,Xi

[ Risk Phrases ]:
R22:Harmful if swallowed. R36/37:Irritating to eyes and respiratory system .

[ Safety Phrases ]:
S22-S36/37/39-S45

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
UD5576750

[ HS Code ]:
2914399090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • trans-1,3-Diphenyl-2-propen-1-ol
  • Acetophenone
  • Benzyl alcohol
  • Benzaldehyde
  • trans-1,3-Diphenyl-2-propen-1-ol
  • Benzenemethanol, a-(2-phenylethynyl)-
  • Phenylacetylene
  • 2-Bromoacetophenone
  • Sodium tetraphenylborate

DownStream

  • 2-oxo-4-(2-phenylethenyl)chromene-3-carbonitrile
  • 2H-1-Benzopyran-2-one,4-hydroxy-3-(3-oxo-1,3-diphenylpropyl)-
  • 2,4-diphenyl-4H-pyrano[3,2-c]chromen-5-one
  • Phenylacetic acid
  • benzoic acid
  • 2-Phenylacetophenone
  • 2-methyl-5,7-diphenyl-6,7-dihydropyrazolo[1,5-a]pyrimidine
  • 2,4,6-TRIPHENYLPYRYLIUM TETRAFLUOROBORATE
  • 1H-Indene, 3-phenyl-
  • 2-Phenylindene

Customs

[ HS Code ]: 2914399090

[ Summary ]:
2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

Articles

Antimycobacterial and anti-inflammatory activities of substituted chalcones focusing on an anti-tuberculosis dual treatment approach.

Molecules 20 , 8072-93, (2015)

Tuberculosis (TB) remains a serious public health problem aggravated by the emergence of M. tuberculosis (Mtb) strains resistant to multiple drugs (MDR). Delay in TB treatment, common in the MDR-TB ca...

Comparative analysis of the main bioactive components of San-ao decoction and its series of formulations.

Molecules 17(11) , 12925-37, (2012)

A high performance liquid chromatographic (HPLC) method with diode array detection (DAD) was established for simultaneous determination of seven main bioactive components in San-ao decoction and its s...

Development of a stability-indicating LC method for determination of a synthetic chalcone derivative in a nanoemulsion dosage form and identification of the main photodegradation product by LC-MS.

J. Pharm. Biomed. Anal. 70 , 652-6, (2012)

This study aimed to develop and validate a stability indicating LC for the determination of 5-(2-benzoylethenyl)-N-benzyl-2 methoxybenzenesulfonamide (SCD - a synthetic chalcone derivative), and evalu...


More Articles

Related Compounds

  • 1,3-diphenyl-2-propen-1-one
  • 1,3-diphenyl-2-propen-1-one,oxime
  • 1,3-diphenyl-2-propen-1-one oxime
  • 1,3-diphenyl-2-propen-1-one oxime
  • 1,3-diphenyl-2-propen-1-one oxime
  • 2-bromo-1,3-diphenyl-2-propen-1-one
  • 1-(2-(Dimethylamino)-2-(thiophen-3-yl)ethyl)-3-phenylurea
  • N-(2-(dimethylamino)-2-(thiophen-3-yl)ethyl)-3,4,5-trimethoxybenzamide
  • N-(2-(dimethylamino)-2-(thiophen-3-yl)ethyl)-2-methylbenzamide
  • Imidazo[1,2-b]pyridazine-6-carbonitrile
  • N-(1-cyanocyclohexyl)-2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}propanamide
  • N-(2-(dimethylamino)-2-(thiophen-3-yl)ethyl)-2,6-difluorobenzamide
  • N-(2-(dimethylamino)-2-(thiophen-3-yl)ethyl)cyclohexanecarboxamide
  • 3-Butylazetidine-2-carboxylic acid
  • N-(2-(dimethylamino)-2-(thiophen-3-yl)ethyl)-2-(trifluoromethyl)benzamide
  • (R)-N-(3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl)acetamide
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