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222143

Sigma-Aldrich

4-Pentylbenzoyl chloride

96%

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About This Item

Linear Formula:
CH3(CH2)4C6H4COCl
CAS Number:
49763-65-7
Molecular Weight:
210.70
EC Number:
256-478-8
MDL number:
MFCD00000700
UNSPSC Code:
12352100
PubChem Substance ID:
24853316
NACRES:
NA.22

Quality Level

100

Assay

96%

form

liquid

refractive index

n20/D 1.53 (lit.)

density

1.036 g/mL at 25 °C (lit.)

functional group

acyl chloride

SMILES string

CCCCCc1ccc(cc1)C(Cl)=O

InChI

1S/C12H15ClO/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h6-9H,2-5H2,1H3

InChI key

FBBRKYLXMNQFQU-UHFFFAOYSA-N

Application

4-Pentylbenzoyl chloride was used in the synthesis of 3-O-acyl derivative by reacting with betulinic acid.

Pictograms

Corrosion
GHS05

Signal Word

Danger

Hazard Statements

H314

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
STBF9371V
07703BE
U17263
03203BD
U14911

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Rama Mukherjee et al.
Bioorganic & medicinal chemistry letters, 14(12), 3169-3172 (2004-05-20)
New 3-O-acyl, 3-benzylidene, 3-hydrazone, 3-hydrazine, 17-carboxyacryloyl ester derivatives of betulinic acid (2-6, 8-11, 13, 17, 18, 21, and 22) were synthesized and evaluated in vitro for anti-angiogenic activity on endothelial cell cytotoxicity, specificity, and tube-formation ability. All derivatives reported here

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