CAS Number523-80-8
SynonymsApiole (parsley); Apiol; 1-allyl-2,5-dimethoxy-3,4-methylenedioxybenzene; Petersiliencampher; 3,6-dimethoxy-4,5-methylenedioxy-allylbenzene; 1-allyl-3,4-methylenedioxy-2,5-dimethoxybenzene; Apiole; Apioline; 5-Allyl-4,7-dimethoxy-1,3-benzodioxole; Parsley apiol; 1,3-Benzodioxole,4,7-dimethoxy-5-(2-propenyl); Parsley apiole; Parsley camphor
Molecular FormulaC12H14O4
Molecular Weight222.24
Purity≥98.0 (GC)%
Density1.151g/cm3
Boiling Point294ºC
Melting Point29ºC
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 523-80-8 |
| Catalog No. | 2A-9083957 |
| Chinese Name | 芹菜脑 |
| Synonyms | Apiole (parsley); Apiol; 1-allyl-2,5-dimethoxy-3,4-methylenedioxybenzene; Petersiliencampher; 3,6-dimethoxy-4,5-methylenedioxy-allylbenzene; 1-allyl-3,4-methylenedioxy-2,5-dimethoxybenzene; Apiole; Apioline; 5-Allyl-4,7-dimethoxy-1,3-benzodioxole; Parsley apiol; 1,3-Benzodioxole,4,7-dimethoxy-5-(2-propenyl); Parsley apiole; Parsley camphor |
| Molecular Formula | C12H14O4 |
| Molecular Weight | 222.24 |
| Purity | ≥98.0 (GC) |
| Density | 1.151g/cm3 |
| Boiling Point | 294ºC |
| Melting Point | 29ºC |
| Storage Condition | The warehouse is ventilated and dried at low tempe |
| Application | Apiole is an anti-tumor agent that induces apoptosis and inhibits human colon cancer cells by inducing G0/G1 cell cycle arrest. Apiole also significantly inhibited colon tumor development in an in viv |
| HTC | 2932999099 |
| SMILES | CC1=C(OCO2)C2=C(C=C1CC=C)OC |
| InChI | 1S/C12H14O3/c1-4-5-9-6-10(13-3)12-11(8(9)2)14-7-15-12/h4,6H,1,5,7H2,2-3H3 |
| InChI Key | RDEQCPAQHKHHHB-UHFFFAOYSA-N |
| NACRES Code | NA.21 |
| UNSPSC | 41116107 |
| MSDS | msds/83957_1_523_80_8.pdf |
| Use of | Properties Name 4,7-dimethoxy-5-prop-2-enyl-1,3-benzodioxole Synonym More Synonyms Apiole (parsley) Biological Activity Related Catalog Signaling Pathways >> Apoptosis >> Apoptosis Research Areas >> Cancer References Chemical & Physical Properties Molecular Formula C12H14O4 Exact Mass 222.08900 PSA 36.92000 LogP 2.16100 Index of Refraction 1.53 InChIKey QQRSPHJOOXUALR-UHFFFAOYSA-N Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : Benzene, 1-allyl-2,5-dimethoxy-3,4-(methylenedioxy)- CAS REGISTRY NUMBER : BEILSTEIN REFERENCE NO. : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C12-H14-O4 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : T56 BO DO CHJ FO1 H2U1 IO1 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Amphibian - frog DOSE/DURATION : TOXIC EFFECTS : Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Behavioral - altered sleep time (including change in righting reflex) Lungs, Thorax, or Respiration - other changes MUTATION DATA TEST SYSTEM : Rodent - mouse DOSE/DURATION : REFERENCE : CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House, Southfield Road, Eynsham, Oxford OX8 1JJ, UK) V.1- 1980- Volume(issue)/page/year: 5,1613,1984 Safety Information HS Code 2932999099 Synthetic Route 4,7-dimethoxy-1... CAS#:23731-75-1 allyl toluene-4... CAS#:4873-09-0 Apiole (parsley) CAS#:523-80-8 Literature: Tsukada, Naofumi; Yagura, Yasushige; Sato, Tetsuo; Inoue, Yoshio Synlett, 2003 , # 10 p. 1431 - 1434 6-allyl-2,3-met... CAS#:109073-00-9 Apiole (parsley) CAS#:523-80-8 Literature: Baker; Savage Journal of the Chemical Society, 1938 , p. 1602,1605 4-allyloxy-benz... CAS#:857579-63-6 Apiole (parsley) CAS#:523-80-8 Literature: Baker; Savage Journal of the Chemical Society, 1938 , p. 1602,1605 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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