2-(4-Chlorophenyl)-2-cyanoacetaldehyde
Names
[ CAS No. ]:
62538-21-0
[ Name ]:
2-(4-Chlorophenyl)-2-cyanoacetaldehyde
[Synonym ]:
2-(4-chlorophenyl)-3-oxopropanenitrile
Chemical & Physical Properties
[ Density]:
1.263 g/cm3
[ Boiling Point ]:
283.8ºC at 760 mmHg
[ Melting Point ]:
157ºC
[ Molecular Formula ]:
C9H6ClNO
[ Molecular Weight ]:
179.60300
[ Flash Point ]:
125.4ºC
[ Exact Mass ]:
179.01400
[ PSA ]:
40.86000
[ LogP ]:
2.14608
[ Index of Refraction ]:
1.552
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AL8310000
- CHEMICAL NAME :
- Acetonitrile, 2-(p-chlorophenyl)-2-formyl-
- CAS REGISTRY NUMBER :
- 62538-21-0
- BEILSTEIN REFERENCE NO. :
- 0743641
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C9-H6-Cl-N-O
- MOLECULAR WEIGHT :
- 179.61
- WISWESSER LINE NOTATION :
- VHYCN&R DG
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 50 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689
Safety Information
[ Hazard Codes ]:
Xn: Harmful;
[ Risk Phrases ]:
R20/21/22;R36/37/38
[ Safety Phrases ]:
S26-S36/37/39
[ RIDADR ]:
UN 3276
[ HS Code ]:
2926909090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2926909090
[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%