2-Phenylpropionaldehyde
Names
[ CAS No. ]:
93-53-8
[ Name ]:
2-Phenylpropionaldehyde
[Synonym ]:
EINECS 202-255-5
Benzeneacetaldehyde, a-methyl-
MFCD00006973
Hydratropic aldehyde
Chemical & Physical Properties
[ Density]:
1.01
[ Boiling Point ]:
201ºC (12 torr)
[ Melting Point ]:
60ºC
[ Molecular Formula ]:
C9H10O
[ Molecular Weight ]:
134.17500
[ Flash Point ]:
169 °F
[ Exact Mass ]:
134.07300
[ PSA ]:
17.07000
[ LogP ]:
1.98900
[ Index of Refraction ]:
n20/D 1.517(lit.)
[ Storage condition ]:
Refrigerator
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- CY1460000
- CHEMICAL NAME :
- Benzeneacetaldehyde, alpha-methyl-
- CAS REGISTRY NUMBER :
- 93-53-8
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C9-H10-O
- MOLECULAR WEIGHT :
- 134.19
- WISWESSER LINE NOTATION :
- VHY1&R
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 :
- 2800 mg/kg
- TOXIC EFFECTS :
- Behavioral - coma Skin and Appendages - hair
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 2,327,1964 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X6712 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 5 No. of Employees: 1557 (estimated) No. of Female Employees: 276 (estimated)
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
[ Risk Phrases ]:
R36/38
[ Safety Phrases ]:
S26-S36
[ RIDADR ]:
NONH for all modes of transport
[ WGK Germany ]:
3
[ RTECS ]:
CY1460000
[ HS Code ]:
2912299000
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2912299000
[ Summary ]:
2912299000. other cyclic aldehydes without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%
Articles
J. Am. Chem. Soc. 124(38) , 11234-5, (2002)
We successfully converted myoglobin, an oxygen-storage hemoprotein, into an oxygen-activating hemoprotein like cytochrome P450s by replacing the native hemin with the artificially created flavohemin. ...
Investigating the role of 2-phenylpropenal in felbamate-induced idiosyncratic drug reactions.Chem. Res. Toxicol. 17(12) , 1568-76, (2004)
Felbamate (2-phenyl-1,3-propanediol dicarbamate, FBM) can cause aplastic anemia and hepatotoxicity. The mechanism of FBM-induced toxicities is unknown; however, it has been proposed that 2-phenylprope...
Synthesis and in vitro reactivity of 3-carbamoyl-2-phenylpropionaldehyde and 2-phenylpropenal: putative reactive metabolites of felbamate.Chem. Res. Toxicol. 9(8) , 1225-9, (1996)
We propose that 3-carbamoyl-2-phenylpropionaldehyde is an intermediate in the metabolism of felbamate, an anti-epileptic drug with a unique profile of the therapeutic activity, and undergoes a cascade...