-
(1R)-TRANS-1,2-CYCLOPENTANDIOL
1. Namen und Bezeichner
- 1.1 Produktname
- (1R)-TRANS-1,2-CYCLOPENTANDIOL
- 1.2 Synonyme
- (1R,2R)-(-)-TRANS-1,2-CYCLOPENTANEDIOL;(1R,2R)-TRANS-1,2-CYCLOPENTANEDIOL;(1R)-TRANS-1,2-CYCLOPENTANEDIOL
- 1.3 CAS No.
- 930-46-1
- 1.4 CID
- 225711
- 1.5 EINECS
- 225-757-6
- 1.6 Summenformel
- C5H10O2
- 1.7 Inchi
- InChI=1S/C5H10O2/c6-4-2-1-3-5(4)7/h4-7H,1-3H2/t4-,5-/m1/s1
- 1.8 InchiKey
- VCVOSERVUCJNPR-RFZPGFLSSA-N
- 1.9 Kanonisch SMILES
- C1CC(C(C1)O)O
- 1.10 Isomere SMILES
- C1C[C@H]([C@@H](C1)O)O
2. Eigenschaften
- 2.1 Schmelzpunkt
- 47-51 ° C (beleuchtet)
- 2.2 Lagerung
- 2-8 ° C
3. Sicherheit
- 3.1 S-Satz
- 22-24 / 25
- 3.2 WGK Deutschland
- 3
- 3.3 Sicherheit und Gefahren
-
| S-Satz |
22-24 / 25 |
| WGK Deutschland |
3
|
| F |
3-10 |
4. SDB-Informationen
2.Hazard identification
2.1 Classification of the substance or mixture
no data available
2.2 GHS label elements, including precautionary statements
| Pictogram(s) | no data available |
| Signal word | no data available |
| Hazard statement(s) | no data available |
| Precautionary statement(s) | |
| Prevention | no data available |
| Response | no data available |
| Storage | no data available |
| Disposal | no data available |
2.3 Other hazards which do not result in classification
no data available
5. NMR Spektrum
6. Synthetischer Weg.
930-46-1Total: 17 Synthetischer Weg.
7. Vorläufer und Produkt
8. Computerchemische Daten
- Molecular Weight：102.13g/mol
- Molecular Formula：C5H10O2
- Compound Is Canonicalized：True
- XLogP3-AA：102.068079557
- Monoisotopic Mass：102.068079557
- Complexity：55.1
- Rotatable Bond Count：0
- Hydrogen Bond Donor Count：2
- Hydrogen Bond Acceptor Count：2
- Topological Polar Surface Area：40.5
- Heavy Atom Count：：7
- Defined Atom Stereocenter Count：2
- Undefined Atom Stereocenter Count：0
- Defined Bond Stereocenter Count：0
- Undefined Bond Stereocenter Count：0
- Isotope Atom Count：0
- Covalently-Bonded Unit Count：1
- CACTVS Substructure Key Fingerprint：AAADccBgMAAAAAAAAAAAAAAAAAAAAYAAAAAAAAAAAAAAAAAAAAAAGgAACAAACBSggAIAAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAABEAIAAAAAQAAEAAABAACAIAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAA==
-
Tel:
Update Time:2018/11/21
-
Tel:
Update Time:2019/02/25
-
Tel:
Update Time:2019/02/24
-
Tel:
Update Time:2019/11/25
-
Tel:
Update Time:2019/11/25
10. Realisierte Produktinformationen
DE
