2-Hydroxy-3-(2-propen-1-yl)benzoic acid methyl ester
Names
[ CAS No. ]:
31456-98-1
[ Name ]:
2-Hydroxy-3-(2-propen-1-yl)benzoic acid methyl ester
[Synonym ]:
3-allyl-2-hydroxy-benzoic acid methyl ester
methyl 3-Allyl-2-Hydroxybenzoate
3-Allylsalicylic acid methyl ester
methyl-2-hydroxy-3-allylbenzoate
Methyl 3-allylsalicylate
Salicylic acid,3-allyl-,methyl ester
Chemical & Physical Properties
[ Density]:
1.129g/cm3
[ Boiling Point ]:
275.7ºC at 760 mmHg
[ Molecular Formula ]:
C11H12O3
[ Molecular Weight ]:
192.21100
[ Flash Point ]:
111.3ºC
[ Exact Mass ]:
192.07900
[ PSA ]:
46.53000
[ LogP ]:
1.90730
[ Index of Refraction ]:
1.545
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- VO1100000
- CHEMICAL NAME :
- Salicylic acid, 3-allyl-, methyl ester
- CAS REGISTRY NUMBER :
- 31456-98-1
- BEILSTEIN REFERENCE NO. :
- 0777684
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C11-H12-O3
- MOLECULAR WEIGHT :
- 192.23
- WISWESSER LINE NOTATION :
- 1U2R BQ CVO1
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 :
- 530 mg/kg
- TOXIC EFFECTS :
- Behavioral - altered sleep time (including change in righting reflex)
- REFERENCE :
- JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 2,213,1960
Safety Information
[ HS Code ]:
2918290000
Synthetic Route
Customs
[ HS Code ]: 2918290000
[ Summary ]:
HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0%