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Key Documents

124338

Sigma-Aldrich

Butyrophenone

≥99%

Synonym(s):

1-Benzoylpropane, 1-Phenyl-1-butanone, NSC 8463, Phenyl propyl ketone

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About This Item

Linear Formula:
C6H5COCH2CH2CH3
CAS Number:
Molecular Weight:
148.20
Beilstein:
508305
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

≥99%

form

liquid

refractive index

n20/D 1.520 (lit.)

bp

228-230 °C (lit.)

mp

11-13 °C (lit.)

density

1.021 g/mL at 25 °C (lit.)

functional group

ketone
phenyl

SMILES string

CCCC(=O)c1ccccc1

InChI

1S/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3

InChI key

FFSAXUULYPJSKH-UHFFFAOYSA-N

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Application

Butyrophenone has been used to study the relationship between the electrolyte counter-ion concentration and the critical micelle concentration for several surfactants. It has been used to generate PhCO+ ions by 70 eV electron ionization.

Biochem/physiol Actions

Butyrophenones constitutes neuroleptic drugs and interacts with the opiate receptor by inhibiting the stereospecific binding of 3H-naloxone.

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

190.4 °F

Flash Point(C)

88 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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