β-D-Glucopyranoside, heptyl supplier

Name
HEPTYL-BETA-D-GLUCOPYRANOSIDE
EINECS 1533716-785-6
CAS No. 78617-12-6
Article Data12
CAS DataBase
Density 1.21 g/cm³
Solubility
Melting Point 74-75℃
Formula C₁₃H₂₆O₆
Boiling Point 443.1 °C at 760 mmHg
Molecular Weight 278.346
Flash Point 221.8 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Heptylb-D-glucoside;Heptyl glucoside;Heptyl b-D-glucopyranoside;n-Heptyl b-D-glucopyranoside;n-Heptyl b-D-glucoside;
PSA 99.38000
LogP -0.22670

Synthetic route

: 28245-00-3
n-heptyl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
With sodium methylate In methanol at 20℃; for 24h;	65%
With methanol; barium methoxide
With sodium methylate In methanol Heating;
With triethylamine In methanol; water at 20℃; for 24h;

: C20H32O11

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
With water; triethylamine In methanol at 50℃; for 14h;	27%

: 2280-44-6
D-Glucose

: 111-70-6
n-heptan1ol

A: heptyl α-D-glucopyranoside, anhydrous

B: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
With sulfuric acid In 1,4-dioxane Yield given;	A 18% B n/a
With sulfuric acid In 1,4-dioxane Yields of byproduct given;	A 18% B n/a

...Expand

: 111-70-6
n-heptan1ol

: 2492-87-7
4-nitrophenyl-β-D-glucoside

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
With phosphate buffer; β-glucosidase at 30℃; for 20h; pH=5;	11%

: 492-61-5
β-D-glucose

: 111-70-6
n-heptan1ol

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
With almond meal In water at 50℃; for 168h; Thermodynamic data; Equilibrium constant; Enzymatic reaction;	4.57%
With almond meal cross-linked with glutaraldehyde In water at 50℃; for 168h; Equilibrium constant; Enzymatic reaction;

: 133-99-3, 490-37-9, 2152-98-9, 4482-75-1, 5965-66-2, 13299-27-9, 13360-52-6, 14641-93-1, 15548-43-3, 16462-44-5, 16984-36-4, 16984-38-6, 20869-27-6, 22688-72-8, 27452-49-9, 29276-55-9, 30608-12-9, 34481-13-5, 37169-60-1, 37169-64-5, 64234-01-1, 64234-02-2, 75281-88-8, 80446-85-1, 84413-57-0, 92344-56-4, 93221-87-5, 93301-77-0, 94799-29-8, 100427-98-3, 100428-00-0, 101312-82-7, 102046-24-2, 102046-25-3, 109432-00-0, 109432-02-2, 109432-04-4, 109432-08-8, 135268-49-4, 138231-26-2, 140461-59-2, 145414-22-8, 145414-26-2, 146339-75-5, 146339-76-6, 149116-55-2, 528-50-7
Cellobiose

: 111-70-6
n-heptan1ol

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
In water at 30℃; for 48h; β-glucosidase from Trichoderma viride; Yield given;

: 111-70-6
n-heptan1ol

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 70 percent / lithium carbonate / CH2Cl2 / 16 h / 30 °C 2: 65 percent / sodium methoxide / methanol / 24 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: silver oxide; calcium sulfate / Reagens 4: Benzol 2: barium methylate; methanol View Scheme

: 572-09-8
2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl bromide

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 70 percent / lithium carbonate / CH2Cl2 / 16 h / 30 °C 2: 65 percent / sodium methoxide / methanol / 24 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: silver oxide; calcium sulfate / Reagens 4: Benzol 2: barium methylate; methanol View Scheme

: 604-69-3
β-D-glucose pentaacetate

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: 90 percent / glacial acetic acid; hydrobromic acid / 2 h / 30 °C 2: 70 percent / lithium carbonate / CH2Cl2 / 16 h / 30 °C 3: 65 percent / sodium methoxide / methanol / 24 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: SnCl4; molecular sieves 4 Angstroem / CH2Cl2 / 1 h / 20 °C 2: NaOMe / methanol / Heating View Scheme

: 111-70-6
n-heptan1ol

: 57-50-1
Sucrose

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
With cellobiose; α-glucose-1-phosphate; cellobiose phosphorylase from Clostridium thermocellum YM4; sucrose phosphorylase from Pseudomonas saccharophilia In phosphate buffer at 40℃; for 20h; pH=7.0;

: 69984-73-2
(2R,3S,4S,5R,6R)-2-Hydroxymethyl-6-nonyloxy-tetrahydro-pyran-3,4,5-triol

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 5391-18-4, 25320-93-8, 39824-09-4, 95531-15-0, 143289-25-2, 146453-36-3, 148347-27-7
n-butyl β-D-glucopyranoside

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 25320-96-1, 39824-10-7, 66957-71-9, 95531-16-1, 100297-02-7, 100297-03-8
1-pentanol β-D-glucopyranoside

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 39824-11-8, 59080-45-4, 95531-17-2, 29781-79-1
n-hexyl-β-D-glucopyranoside

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 58846-77-8
n-decyl β-D-glucopyranoside

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 111-70-6
n-heptan1ol

: 56401-20-8
α-D-Glucopyranoside 1-(disodium phosphate)

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
With cellobiose phosphorylase from Clostridium thermocellum In aq. buffer at 50℃; for 48h; pH=6.5; Enzymatic reaction;

: 25320-91-6, 34384-77-5, 39824-08-3, 62178-32-9, 63223-88-1, 73351-01-6, 95586-01-9, 118245-33-3, 118245-34-4
propyl Β-D-glucopyranoside

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 29836-26-8
n-octyl β-D-glucopyranoside

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 111-70-6
n-heptan1ol

: pentaacetyl-β-D-glucose

: 78617-12-6
n-heptyl beta-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: boron trifluoride diethyl etherate / dichloromethane / 24 h / 0 - 20 °C 2: triethylamine; water / methanol / 14 h / 50 °C View Scheme

: 78617-12-6
n-heptyl beta-D-glucopyranoside

: 98-80-6
phenylboronic acid

: heptyl β-D-glucopyranoside 4,6-phenylboronate

Conditions

Conditions	Yield
at 90℃; under 0.1 Torr; for 0.25h;	99%

: 78617-12-6
n-heptyl beta-D-glucopyranoside

: 69984-73-2
(2R,3S,4S,5R,6R)-2-Hydroxymethyl-6-nonyloxy-tetrahydro-pyran-3,4,5-triol

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 78617-12-6
n-heptyl beta-D-glucopyranoside

A: 492-61-5
β-D-glucose

B: 111-70-6
n-heptan1ol

Conditions

Conditions	Yield
With water at 50℃; Equilibrium constant; Enzymatic reaction;
With almond meal In water at 50℃; for 168h; Thermodynamic data; Equilibrium constant;

: 78617-12-6
n-heptyl beta-D-glucopyranoside

: 25320-96-1, 39824-10-7, 66957-71-9, 95531-16-1, 100297-02-7, 100297-03-8
1-pentanol β-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 78617-12-6
n-heptyl beta-D-glucopyranoside

: 39824-11-8, 59080-45-4, 95531-17-2, 29781-79-1
n-hexyl-β-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 78617-12-6
n-heptyl beta-D-glucopyranoside

: 58846-77-8
n-decyl β-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: water / 50 °C / Enzymatic reaction 2: almond meal cross-linked with glutaraldehyde / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 78617-12-6
n-heptyl beta-D-glucopyranoside

: 25320-91-6, 34384-77-5, 39824-08-3, 62178-32-9, 63223-88-1, 73351-01-6, 95586-01-9, 118245-33-3, 118245-34-4
propyl Β-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 78617-12-6
n-heptyl beta-D-glucopyranoside

: 5391-18-4, 25320-93-8, 39824-09-4, 95531-15-0, 143289-25-2, 146453-36-3, 148347-27-7
n-butyl β-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 78617-12-6
n-heptyl beta-D-glucopyranoside

: 29836-26-8
n-octyl β-D-glucopyranoside

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: almond meal / water / 168 h / 50 °C 2: almond meal / water / 168 h / 50 °C / Enzymatic reaction View Scheme

: 78617-12-6
n-heptyl beta-D-glucopyranoside

A: 50-99-7
D-glucose

B: 111-70-6
n-heptan1ol

Conditions

Conditions	Yield
With recombinant Solanum torvum GH3 β-glucosidase with a polyhistidine tag at 37℃; pH=5; Enzymatic reaction;

β-D-Glucopyranoside, heptyl Specification

The β-D-Glucopyranoside, heptyl is an organic compound with the formula C₁₃H₂₆O₆. The systematic name of this chemical is heptyl beta-D-glucopyranoside. With the CAS registry number 78617-12-6, it is also named as Heptyl-β-D-glucopyranoside solution. The product's categories are Detergents; Detergents A to ZDetergents; Non-Ionic. Besides, it should be stored at temperature of -20 °C.

Physical properties about β-D-Glucopyranoside, heptyl are: (1)ACD/LogP: 0.50; (2)#H bond acceptors: 6; (3)#H bond donors: 4; (4)#Freely Rotating Bonds: 12; (5)Polar Surface Area: 55.38 Å²; (6)Index of Refraction: 1.518; (7)Molar Refractivity: 69.7 cm³; (8)Molar Volume: 229.9 cm³; (9)Polarizability: 27.63×10^-24cm³; (10)Surface Tension: 52.7 dyne/cm; (11)Density: 1.21 g/cm³; (12)Flash Point: 221.8 °C; (13)Enthalpy of Vaporization: 80.86 kJ/mol; (14)Boiling Point: 443.1 °C at 760 mmHg; (15)Vapour Pressure: 1.03E-09 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O(CCCCCCC)[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO
(2)InChI: InChI=1/C13H26O6/c1-2-3-4-5-6-7-18-13-12(17)11(16)10(15)9(8-14)19-13/h9-17H,2-8H2,1H3/t9-,10-,11+,12-,13-/m1/s1
(3)InChIKey: NIDYWHLDTIVRJT-UJPOAAIJBB
(4)Std. InChI: InChI=1S/C13H26O6/c1-2-3-4-5-6-7-18-13-12(17)11(16)10(15)9(8-14)19-13/h9-17H,2-8H2,1H3/t9-,10-,11+,12-,13-/m1/s1
(5)Std. InChIKey: NIDYWHLDTIVRJT-UJPOAAIJSA-N

Product Name

HEPTYL-BETA-D-GLUCOPYRANOSIDE

Synthetic route

β-D-Glucopyranoside, heptyl Specification

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