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Grundinformationen
- Standard-SMILES
CCN(CC)CCOc1ccc2c(c1)C(=O)c1cc(OCCN(CC)CC)ccc1-2.Cl.Cl
Namen und Bezeichner
Datenbank-Bezeichner
- CAS
27591-69-1- PubChem CID
- 33958
- ChEMBL
CHEMBL539581- ChEBI
CHEBI:147356- UNII
- BJ507J4LKY
- EC Number
- 631-065-9
Eigenschaften
Physikochemische Eigenschaften
- Melting point
- 230 · 230-233 °C(lit.)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Methanol (Slightly)
- form
- Solid
- color
- Orange
- Merck
- 14 · 14,9440
- InChI
- InChI=1S/C25H34N2O3.2ClH/c1-5-26(6-2)13-15-29-19-9-11-21-22-12-10-20(30-16-14-27(7-3)8-4)18-24(22)25(28)23(21)17-19;;/h9-12,17-18H,5-8,13-16H2,1-4H3;2*1H
- InChIKey
- BSVYJQAWONIOOU-UHFFFAOYSA-N
- SMILES
- C12C=CC(OCCN(CC)CC)=CC=1C(=O)C1C=C(OCCN(CC)CC)C=CC2=1.Cl.Cl
- CAS DataBase Reference
- 27591 · 27591-69-1(CAS DataBase Reference)
- FDA UNII
- 507 J4LKY · BJ507J4LKY
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07,GHS08
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335-H351
- Precautionary statements
- 280 · P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338-P308+P313
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22-36/37/38-40
- Safety Statements
- 7 · 7-22-26-37/39
- WGK Germany
- 3 · 3
- RTECS
- 9000000 · LL9000000
- HS Code
- 2922.39 · 2922.39.4500
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 DermalAcute · Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralCarc. 2Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Toxicity
- 50 in · LD50 in mice, rats (single dose): 959, 852 mg/kg orally; 145, 244 mg/kg i.p. (Krueger, Mayer)
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