3-Benzylidenphthalide
Names
[ CAS No. ]:
575-61-1
[ Name ]:
3-Benzylidenphthalide
[Synonym ]:
EINECS 209-388-8
MFCD00005929
1(3H)-Isobenzofuranone, 3-(phenylmethylene)-, (3E)-
(3E)-3-Benzylidene-2-benzofuran-1(3H)-one
3-Benzylidenphthalide
benzalphthalide
Biological Activity
[Description]:
[Related Catalog]:
[References]
Chemical & Physical Properties
[ Density]:
1.3±0.1 g/cm3
[ Boiling Point ]:
374.1±42.0 °C at 760 mmHg
[ Melting Point ]:
99-102 °C(lit.)
[ Molecular Formula ]:
C15H10O2
[ Molecular Weight ]:
222.24
[ Flash Point ]:
156.9±25.3 °C
[ Exact Mass ]:
222.068085
[ PSA ]:
26.30000
[ LogP ]:
4.27
[ Vapour Pressure ]:
0.0±0.8 mmHg at 25°C
[ Index of Refraction ]:
1.687
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- TI3686000
- CHEMICAL NAME :
- Phthalide, 3-benzylidene-
- CAS REGISTRY NUMBER :
- 575-61-1
- BEILSTEIN REFERENCE NO. :
- 0083797
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C15-H10-O2
- MOLECULAR WEIGHT :
- 222.25
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- 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
- 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: 5,143,1953
Safety Information
[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
[ Hazard Codes ]:
Xn
[ Risk Phrases ]:
R20/21/22
[ Safety Phrases ]:
S24/25
[ RIDADR ]:
NONH for all modes of transport
[ WGK Germany ]:
3
[ RTECS ]:
TI3686000
[ HS Code ]:
2932209090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2932209090
[ Summary ]:
2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%