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4-Phenyl-2-butanone

CAT: 0572-TRC-P319760-100GSize: 100 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-P319760-100GSize:100 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2550-26-7
Synonyms
4-Phenyl-2-butanone; 1-Phenyl-3-butanone; 2-Phenylethyl methyl ketone; Benzylacetone; Methyl 2-phenylethyl ketone; Methyl phenethyl ketone; NSC 44829; NSC 813; Phenethyl methyl ketone
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
CC(=O)CCc1ccccc1
Molecular Formula
C10 H12 O
Molecular Weight
148.202
InChI
InChI=1S/C10H12O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
Additionnal Information
IUPAC name: 4-phenylbutan-2-one
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

Benzyl acetone

4-phenylbutan-2-one is a ketone.

CAS Number2550-26-7
PubChem CID17355
IUPAC Name4-phenylbutan-2-one
Molecular FormulaC10H12O
Molecular Weight148.20
XLogP1.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity123
SMILES
CC(=O)CCC1=CC=CC=C1
InChI
InChI=1S/C10H12O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
InChIKey
AKGGYBADQZYZPD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzyl acetone
CAS: 2550-26-7
CID: 17355
Formula: C10H12O
MW: 148.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight148.20
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass148.088815002
Monoisotopic Mass148.088815002
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity123
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
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TRC-H949420-250MG2-(4-Hydroxyphenyl)-1-phenyl-1-butanone
TRC-D452360-250MG3’,4’-Dihydroxy-1-phenyl-2-butanone
TRC-D418015-50MG3’,4’-Dibenzyloxy-1-phenyl-2-butanone
TRC-D418015-100MG3’,4’-Dibenzyloxy-1-phenyl-2-butanone
TRC-D418015-5MG3’,4’-Dibenzyloxy-1-phenyl-2-butanone
TRC-H949420-25MG2-(4-Hydroxyphenyl)-1-phenyl-1-butanone
TRC-D452360-500MG3’,4’-Dihydroxy-1-phenyl-2-butanone
TRC-D461360-1G1-[4-[2-Dimethylamino)ethoxy]phenyl]-2-phenyl-1-butanone Hydrochloride
TRC-D461362-25MG1-[4-[2-Dimethylamino)ethoxy]phenyl]-2-phenyl-1-butanone-d6 Hydrochloride

Alternative Products

CatalogName
FP32146-014-Phenyl-2-butanone
424356-013-Bromo-4-phenyl-2-butanone
sc-2767224- (3,4-Methylenedioxy) phenyl-2-butanone
sc-2298051-Phenyl-2-butanone
FH24460-011- (4-Hydroxyphenyl) -2-phenyl-1-butanone
0099403’,4’-Dihydroxy-1-phenyl-2-butanone
0090103’,4’-Dibenzyloxy-1-phenyl-2-butanone
MBS6018304-011-(4-Hydroxyphenyl)-2-phenyl-1-butanone
sc-4833951- (4-Methoxyphenyl) -2-phenyl-1-butanone
MBS6054539-012-(4-Hydroxyphenyl)-1-phenyl-1-butanone

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