2-Benzylcyclohexanone
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2-Benzylcyclohexanone
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CAS No:
946-33-8
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Formula:
C13H16O
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Chemical Name:
2-Benzylcyclohexanone
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Synonyms:
Cyclohexanone,2-(phenylmethyl)-;Cyclohexanone,2-benzyl-;2-(Phenylmethyl)cyclohexanone;2-Benzylcyclohexanone;α-Benzylcyclohexanone;(±)-2-Benzylcyclohexanone;(±)-2-Benzyl-1-cyclohexanone;NSC 149930;2-Benzylcyclohexan-1-one;2702-74-1;91603-45-1
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CAS No:
Characteristics
17.1
2.98840
1.0733 g/cm3 @ Temp: 0 °C
76 °C
165-166 °C @ Press: 18 Torr
>230 °F
n20/D 1.536(lit.)
Safety Information
NONH for all modes of transport
3
36/37/38
26-36
Xi
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:188.26
XLogP3:2.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:188.120115130
Monoisotopic Mass:188.120115130
Topological Polar Surface Area:17.1
Heavy Atom Count:14
Complexity:191
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes