ChemicalBook > CAS DataBase List > 5-Heptylresorcinol

5-Heptylresorcinol

Product Name
5-Heptylresorcinol
CAS No.
500-67-4
Chemical Name
5-Heptylresorcinol
Synonyms
SPHEROPHORAL;5-Heptylbenzene-1,3-diol;spherophorol;5-Heptyl-1,3-benzenediol;5-HEPTYLRESORCINOL;7-methylheptanoicacid;5-HEPTYLRESORCINOL 95%;3,5-Dihydroxyheptylbenzene;1,3-Benzenediol, 5-heptyl-
CBNumber
CB5456174
Molecular Formula
C13H20O2
Formula Weight
208.3
MOL File
500-67-4.mol
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5-Heptylresorcinol Property

Melting point:
55-57°C
Boiling point:
342.3±12.0 °C(Predicted)
Density 
1.033±0.06 g/cm3(Predicted)
storage temp. 
Refrigerator, under inert atmosphere
solubility 
DMSO (Slightly), Methanol (Slightly)
form 
Solid
pka
9.57±0.10(Predicted)
color 
White to Off-White
InChI
InChI=1S/C13H20O2/c1-2-3-4-5-6-7-11-8-12(14)10-13(15)9-11/h8-10,14-15H,2-7H2,1H3
InChIKey
QENPJKGENOZEEJ-UHFFFAOYSA-N
SMILES
C1(O)=CC(CCCCCCC)=CC(O)=C1
NIST Chemistry Reference
5-Heptylresorcinol(500-67-4)
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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

TRC
Product number
H267500
Product name
5-Heptylresorcinol
Packaging
10mg
Price
$100
Updated
2021/12/16
TRC
Product number
H267500
Product name
5-Heptylresorcinol
Packaging
1g
Price
$2665
Updated
2021/12/16
Chemenu
Product number
CM328669
Product name
5-heptylbenzene-1,3-diol
Purity
95%+
Packaging
1000g
Price
$17280
Updated
2021/12/16
AHH
Product number
MT-14529
Product name
5-Heptylresorcinol
Purity
95%
Packaging
5g
Price
$735
Updated
2021/12/16
Chemenu
Product number
CM328669
Product name
5-heptylbenzene-1,3-diol
Purity
95%+
Packaging
10g
Price
$1012
Updated
2021/12/16
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5-Heptylresorcinol Chemical Properties,Usage,Production

Uses

5-Heptylresorcinol and other alkylhydroxybenzenes have been used to study the protective effect in Saccharomyces cerevisiae against oxidative and radiation-caused damage.

Definition

5-Heptylresorcinol is one of the main volatile compounds present in F. japonicum stem oils (6.5%) which presented apparent antioxidant and antibacterial capacities[1]. It is a cannabinoid compound related to the structure of cannabinoids, which has been shown to have cannabinoid effects in animals and humans.

Biological Activity

5-Heptylresorcinol binds to CB1 receptor with high strength and selectivity, and has been shown to induce low metabolism in mice by selectively binding CB1 at large doses

Synthesis

To a solution of 1-heptyl-3,5-dimethoxy-Benzene (388 mg, 1.41 mmol) in dry CH2Cl2 (47 mL) at -78 °C under an argon atmosphere was added boron tribromide (3.4 mL, 1 M solution in CH2Cl2). Following this addition, the reaction temperature was gradually raised over a period of 3 h to 0 °C, and the stirring continued at that temperature until the reaction was completed (28 h). Unreacted boron tribromide was destroyed by adding methanol at -78 °C. The resulting mixture was warmed at room temperature and stirred for 40 min, and the volatiles were removed in vacuo. The residue was diluted with EtOAc and washed with saturated NaHCO3 solution, water, and brine. The organic layer was dried over Na2SO4, filtered, and concentrated under reduced pressure. Purification by flash column chromatography (45% diethyl etherpetroleum ether) afforded 340 mg (97% yield) of the compound as a slightly brown viscous oil: 5-Heptylresorcinol (. The synthesis was carried out as described for 5-Heptylresorcinol by using 15 (1.18 g, 5 mmol) and boron tribromide (11 mL, 11 mmol, 1 M solution in CH2Cl2) in anhydrous CH2Cl2 (40 mL): yield 91% (0.95 g); slightly brown solid; mp 53-54 °C (lit.63 mp 55-56 °C); spectral and analytical data were reported previously.

References

[1] Wei Q R, et al. Composition and Antioxidative and Antibacterial Activities of the Essential Oil from Farfugium japonicum. Molecules, 2023; 28: 2774.

5-Heptylresorcinol Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 5-Heptylresorcinol manufacturers

Hebei Zhuanglai Chemical Trading Co Ltd
Product
5-Heptylresorcinol 500-67-4
Price
US $10.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
20 ton
Release date
2024-11-15
Shandong Deshang Chemical Co., Ltd.
Product
5-Heptylresorcinol 500-67-4
Price
US $5.90-3.20/kg
Min. Order
1kg
Purity
99%
Supply Ability
10 tons
Release date
2024-06-26
Hebei Yanxi Chemical Co., Ltd.
Product
5-heptylbenzene-1,3-diol 500-67-4
Price
US $40.00/kg
Min. Order
1kg
Purity
0.99
Supply Ability
10 tons
Release date
2023-09-21

500-67-4, 5-HeptylresorcinolRelated Search:


  • SPHEROPHORAL
  • 1,3-Benzenediol, 5-heptyl-
  • 5-Heptyl-1,3-benzenediol
  • 5-HEPTYLRESORCINOL
  • 5-Heptylbenzene-1,3-diol
  • 5-HEPTYLRESORCINOL 95%
  • spherophorol
  • 3,5-Dihydroxyheptylbenzene
  • 7-methylheptanoicacid
  • 500-67-4
  • HO2C6H3CH26CH3