Gamma-Phenyl-Gamma-butyrolactone
- Nom de l'IUPAC：5-phenyloxolan-2-one
- Numéro CAS: 1008-76-0
- Masse moléculaire：162.1852
1. nom et identifiant
- 1.1 Nom du produit
- Gamma-Phenyl-Gamma-butyrolactone
- 1.2 Synonymes
(±)-γ-Phenyl-γ-butyrolactone (RS)-γ-Phenyl-γ-butyrolactone 2(3H)-Furanone, dihydro-5-phenyl- 2,3-Dihydro-5-phenyl-2-furanone 4,5-Dihydro-5-phenyl-2(3H)-furanone 4-Phenyl-4-butanolide 4-Phenyl-4-hydroxybutanoic acid lactone 4-Phenylbutanolide 4-Phenyl-γ-butyrolactone 5-Phenyldihydrofuran-2(3H)-one 5-Phenyltetrahydrofuran-2-one Butyric acid, 4-hydroxy-4-phenyl-, γ-lactone Dihydro-5-phenyl-2(3H)furanone Dihydro-5-phenyl-2(3H)-furanone Dihydro-5-phenyl-2-furanone NSC 24259 NSC 48048 γ-Phenylbutyrolactone γ-Phenyl-γ-butanolide γ-Phenyl-γ-butyrolactone
- Voir tous
- 1.3 Numéro CAS
- 1008-76-0
- 1.4 CID
- 13884
- 1.5 Numéro EINECS
- 213-761-0
- 1.6 Formule moléculaire
- C10H10O2 (isomer)
- 1.7 Inchi
- InChI=1S/C10H10O2/c11-10-7-6-9(12-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2
- 1.8 InchiKey
- AEUULUMEYIPECD-UHFFFAOYSA-N
- 1.9 Canonique SMILES
- C1CC(=O)OC1C2=CC=CC=C2
- 1.10 Isomérique SMILES
- C1CC(=O)OC1C2=CC=CC=C2
2. Propriétés
- 2.1 Densité
- 1.15
- 2.2 Point de fusion
- 36-37℃
- 2.3 Point d'ébullition
- 306℃
- 2.4 Indice de réfraction
- 1.5415-1.5435
- 2.5 Point d'éclair
- 135.5°C
- 2.6 PSA
- 26.30000
- 2.7 logP
- 2.06470
3. Sécurité et Manipulation
- 3.1 Wgk Allemagne
- 3
- 3.2 RTECS
- LU3690000
4. MSDS
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
6. données chimiques calculées
- Masse moléculaire: 162.1852g/mol
- Formule moléculaire: C10H10O2
- Compound Is Canonicalized: True
- XLogP3-AA: 1.7
- Exact Mass: 162.068079557
- Monoisotopic Mass: 162.068079557
- Complexity: 171
- Rotatable Bond Count: 1
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Topological Polar Surface Area: 26.3
- Heavy Atom Count: 12
- 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: AAADccBwMAAAAAAAAAAAAAAAAAAAASAAAAAwAAAAAAAAAAABAAAAGgAAAAAADBSgmAIwCIAABACIAiDSCAACAAAgAAAIiAEACIgIJjKAMRiCMAAkwAEIqAeKyLCOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
7. Fournisseurs recommandés
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- Products:Chemical products
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8. informations réelles sur le produit
skype
4YRS
