-
ÉTER BUTÍLICO DE PROPILENGLICOL
1. Nombres y Identificadores
- 1.1 Nombre del producto
- ÉTER BUTÍLICO DE PROPILENGLICOL
- 1.2 Sinónimos
- 1-propanol, 2-butoxi-;2-BUTOXY-1-PROPANOL;beta propilenglicol butil éter;HOC3H6OC4H9
- 1.3 CAS No.
- 15821-83-7
- 1.4 CID
- 177691
- 1.5 Número EINECS
- 605-138-0
- 1.6 Fórmula molecular
- C7H16O2
- 1.7 Inchi
- InChI=1S/C7H16O2/c1-3-4-5-9-7(2)6-8/h7-8H,3-6H2,1-2H3
- 1.8 InchiKey
- WGKZYJXRTIPTCV-UHFFFAOYSA-N
- 1.9 Canónico SMILES
- CCCCOC(C)CO
- 1.10 Isómero SMILES
- CCCCOC(C)CO
2. Propiedades
- 2.1 pKa
- 14.47±0.10(Predicted)
3. MSDS
2.Hazard identification
2.1 Classification of the substance or mixture
Not classified.
2.2 GHS label elements, including precautionary statements
| Pictogram(s) | No symbol. |
| Signal word | No signal word. |
| Hazard statement(s) | none |
| Precautionary statement(s) | |
| Prevention | none |
| Response | none |
| Storage | none |
| Disposal | none |
2.3 Other hazards which do not result in classification
none
4. Árbol de objetos
15821-83-7Total: 8 Árbol de objetos
5. Precursores y productos
6. Datos químicos computacionales
- Molecular Weight：132.20100g/mol
- Molecular Formula：C7H16O2
- Compound Is Canonicalized：True
- Exact Mass：1.1
- XLogP3-AA：132.115029749
- Monoisotopic Mass：132.115029749
- Complexity：54.9
- Rotatable Bond Count：5
- Hydrogen Bond Donor Count：1
- Hydrogen Bond Acceptor Count：2
- Topological Polar Surface Area：29.5
- Heavy Atom Count：：9
- Defined Atom Stereocenter Count：0
- Undefined Atom Stereocenter Count：1
- Defined Bond Stereocenter Count：0
- Undefined Bond Stereocenter Count：0
- Isotope Atom Count：0
- Covalently-Bonded Unit Count：1
- CACTVS Substructure Key Fingerprint：AAADceBgMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACBSggAICAAAABgAAAAAAAAAAAAAAAAAAAAAAAAABEAAAAAACQAAEAAADAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
-
Tel:
Update Time:2023/06/28
-
Tel:
Update Time:2024/11/15
-
Tel:
Update Time:2024/10/29
-
Tel:
Update Time:2019/04/01
-
Tel:
Update Time:2019/04/01
8. información real del producto
ES
