1-[2-methoxy-6-[(propan-2-ylamino)methyl]-4-prop-2-enylphenoxy]propane-1,3-diol
Names
[ CAS No. ]:
102612-76-0
[ Name ]:
1-[2-methoxy-6-[(propan-2-ylamino)methyl]-4-prop-2-enylphenoxy]propane-1,3-diol
[Synonym ]:
3-(4-Allyl-2-((isopropylamino)methyl)-6-methoxyphenoxy)-1,3-propanediol
1,3-Propanediol,3-(4-allyl-2-((isopropylamino)methyl)-6-methoxyphenoxy)
Chemical & Physical Properties
[ Density]:
1.084g/cm3
[ Boiling Point ]:
463.7ºC at 760mmHg
[ Molecular Formula ]:
C17H27NO4
[ Molecular Weight ]:
309.40100
[ Flash Point ]:
234.2ºC
[ Exact Mass ]:
309.19400
[ PSA ]:
70.95000
[ LogP ]:
2.39220
[ Vapour Pressure ]:
2.13E-09mmHg at 25°C
[ Index of Refraction ]:
1.53
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- TY2655000
- CHEMICAL NAME :
- 1,3-Propanediol, 3-(4-allyl-2-((isopropylamino)methyl)-6-methoxyphenox y)-
- CAS REGISTRY NUMBER :
- 102612-76-0
- LAST UPDATED :
- 198609
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C17-H27-N-O4
- MOLECULAR WEIGHT :
- 309.45
- WISWESSER LINE NOTATION :
- Q1YQ1OR BO1 D2U1 F1MY1&1
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 :
- 84 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Behavioral - changes in motor activity (specific assay) Vascular - shock
- REFERENCE :
- FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 19,324,1964