549959
2-Benzylcyclohexanone
≥97%
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About This Item
Linear Formula:
C6H5CH2C6H9O
CAS Number:
Molecular Weight:
188.27
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
213-420-6
MDL number:
Assay:
≥97%
assay
≥97%
refractive index
n20/D 1.536 (lit.)
bp
103-105 °C/0.2 mmHg (lit.)
density
1.024 g/mL at 25 °C (lit.)
SMILES string
O=C1CCCCC1Cc2ccccc2
InChI
1S/C13H16O/c14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2
InChI key
CUYLPYBYCYQGCE-UHFFFAOYSA-N
General description
2-Benzylcyclohexanone is a 2-substituted cyclohexanone derivative that can be prepared by the catalytic hydrogenation of 2-benzalcyclohexanone.
Application
2-Benzylcyclohexanone may be used in the preparation of ethyl 1-hydroxy-2-benzylcyclohexylacetate.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
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Dialkylaminoalkyl Derivatives of 10,11-Dihydro-5H-dibenzo[a,d]cycloheptene and Related Compounds.
Villani FJ, et al.
Journal of Medicinal Chemistry, 5(2), 373-383 (1962)
Chemistry of carbanions. XIX. Alkylation of enolates from unsymmetrical ketones.
House HO, et al.
The Journal of Organic Chemistry, 36(16), 2361-2371 (1971)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 549959-5G | 04061836686086 |
| 549959-1G | 04061836686079 |