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738-87-4

Basic Information
CAS No.: 738-87-4
Name: Sterculic acid
Article Data: 6
Molecular Structure:
Molecular Structure of 738-87-4 (Sterculic acid)
Formula: C19H34O2
Molecular Weight: 294.478
Synonyms: Sterculicacid;Sterculinic acid;
Density: 0.948 g/cm3
Melting Point: 19 °C
Boiling Point: 418.7 °C at 760 mmHg
Flash Point: 315.4 °C
PSA: 37.30000
LogP: 6.25260
Synthetic route
143-33-9

sodium cyanide

152389-88-3

1-(7-Iodo-heptyl)-2-octyl-cyclopropene

738-87-4

sterculic acid

Conditions
ConditionsYield
With sodium hydroxide
51526-03-5

1,ω-diiodoheptane

738-87-4

sterculic acid

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: butyl lithium, HMPA / Ambient temperature
2: aq. NaOH
View Scheme
108176-04-1

1,1,2-tribromo-2-n-octylcyclopropane

738-87-4

sterculic acid

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: butyl lithium, HMPA / Ambient temperature
2: aq. NaOH
View Scheme
738-87-4

sterculic acid

4675-61-0

cis-8-(2-octylcyclopropyl)octanoic acid

Conditions
ConditionsYield
With Lindlar's catalyst; ethanol Hydrogenation;
738-87-4

sterculic acid

74-88-4

methyl iodide

3220-60-8

methyl sterculate

Conditions
ConditionsYield
With tetra(n-butyl)ammonium hydroxide In dichloromethane
Downstream Products
3220-60-8
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  • 2-octyl-1-Cyclopropene-1-octanoic acid

  • Casno:

    738-87-4

    2-octyl-1-Cyclopropene-1-octanoic acid

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    2-octyl-1-Cyclopropene-1-octanoic acidAppearance:white crystalline powder Storage:Shading, sealed, dry place. Package:aluminous bag Application:API Transportation:SEA OR AIR

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  • 2-octyl-1-Cyclopropene-1-octanoic acid

  • Casno:

    738-87-4

    2-octyl-1-Cyclopropene-1-octanoic acid

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  • 1-Cyclopropene-1-octanoicacid, 2-octyl-

  • Casno:

    738-87-4

    1-Cyclopropene-1-octanoicacid, 2-octyl-

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  • 738-87-4

  • Casno:

    738-87-4

    738-87-4

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    2-octyl-1-Cyclopropene-1-octanoic acid Application:API

    We are Hebei minshang biotechnology co. LTD., mainly deal in pharmaceutical intermediates and various chemicals. We are manufacturers and have our own factory. Products & Usage Ph

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  • 2-octyl-1-Cyclopropene-1-octanoic acid

  • Casno:

    738-87-4

    2-octyl-1-Cyclopropene-1-octanoic acid

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    2-octyl-1-Cyclopropene-1-octanoic acidAppearance:white crystalline powder Storage:Shading, sealed, dry place. Package:aluminous bag Application:API Transportation:SEA OR AIR

    Shanghai PengMo Biotechnology Co., Ltd. is engaging in researching, developing, manufacturing and exporting advanced pharmaceutical intermediates and other fine chemicals. Our comp

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  • 738-87-4

  • Casno:

    738-87-4

    738-87-4

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  • Sterculic acid

  • Casno:

    738-87-4

    Sterculic acid

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Prime Molecular Co., Ltd. is a high-tech enterprise providing comprehensive customer service for pharmaceutical companies at home and abroad in accordance with international standards. Two R&D centers and two production sites in China, all well-equip

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Specification

The Sterculic acid, with CAS registry number 738-87-4, has the systematic name of 8-(2-octylcycloprop-1-en-1-yl)octanoic acid. And its IUPAC name is the same one. Besides this, it is also called 1-Cyclopropene-1-octanoic acid, 2-octyl-.

Physical properties about this chemical are: (1)ACD/LogP: 7.72; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.92; (4)ACD/LogD (pH 7.4): 5.13; (5)ACD/BCF (pH 5.5): 68964.09; (6)ACD/BCF (pH 7.4): 1106.15; (7)ACD/KOC (pH 5.5): 60059.03; (8)ACD/KOC (pH 7.4): 963.32; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.486; (14)Molar Refractivity: 89.24 cm3; (15)Molar Volume: 310.3 cm3; (16)Polarizability: 35.37×10-24cm3; (17)Surface Tension: 36.7 dyne/cm; (18)Enthalpy of Vaporization: 73.74 kJ/mol; (19)Vapour Pressure: 3.49E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: O=C(O)CCCCCCC/C1=C(/C1)CCCCCCCC
(2)InChI: InChI=1/C19H34O2/c1-2-3-4-5-7-10-13-17-16-18(17)14-11-8-6-9-12-15-19(20)21/h2-16H2,1H3,(H,20,21)
(3)InChIKey: PQRKPYLNZGDCFH-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C19H34O2/c1-2-3-4-5-7-10-13-17-16-18(17)14-11-8-6-9-12-15-19(20)21/h2-16H2,1H3,(H,20,21)
(5)Std. InChIKey: PQRKPYLNZGDCFH-UHFFFAOYSA-N