CAS No.43119-47-7,VITAMIN E NICOTINATE Suppliers

Products Categories

Pharmaceutical (34)
Organic Chemicals (7)
Others (4)
Reagent (3)
Basic Inorganic Chemicals (1)

Basic Information

Molecular Structure:
CAS No.:	43119-47-7
Name:	VITAMIN E NICOTINATE

Formula:	C₃₅H₅₃NO₃
Molecular Weight:	535.8
Synonyms:	3-Pyridinecarboxylicacid, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ylester, [2R-[2R(4R,8R*)]]-;Hijuven;Juvela nicotinate;Renascin;Tocopherolnicotinate;Tocopheryl nicotinate;Vitamin E nicotinate;Vitamin E nicotinicacid ester;
EINECS:	257-501-4
Density:	0.99 g/cm³
Boiling Point:	649 °C at 760 mmHg
Flash Point:	346.3 °C
PSA:	48.42000
LogP:	9.74880

Total:48 Page 1 of 2 1 2 Next>>

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

What can I do for you?
Get Best Price

Get Best Price for 43119-47-7

Specification

The 3-Pyridinecarboxylicacid,(2R)-3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ylester, with the CAS registry number 43119-47-7, is also known as 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl pyridine-3-carboxylate. It belongs to the product category of Organics. Its EINECS registry number is 257-501-4. This chemical's molecular formula is C₃₅H₅₃NO₃ and molecular weight is 535.8. What's more, its IUPAC name is called [(2R)-2,5,7,8-Tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] pyridine-3-carboxylate. The classification code is Drug / Therapeutic Agent.

Physical properties about 3-Pyridinecarboxylicacid,(2R)-3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ylester are: (1)ACD/LogP: 12.81; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 12.81; (4)ACD/LogD (pH 7.4): 12.81; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 48.42 Å²; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 162.91 cm³; (15)Molar Volume: 540.9 cm³; (16)Surface Tension: 37.5 dyne/cm; (17)Density: 0.99 g/cm³; (18)Flash Point: 346.3 °C; (19)Enthalpy of Vaporization: 95.68 kJ/mol; (20)Boiling Point: 649 °C at 760 mmHg; (21)Vapour Pressure: 9.93E-17 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(Oc2c(c(c1OC(CCc1c2C)(C)CCCC(C)CCCC(C)CCCC(C)C)C)C)c3cccnc3
(2) InChI: InChI=1/C35H53NO3/c1-24(2)13-9-14-25(3)15-10-16-26(4)17-11-20-35(8)21-19-31-29(7)32(27(5)28(6)33(31)39-35)38-34(37)30-18-12-22-36-23-30/h12,18,22-26H,9-11,13-17,19-21H2,1-8H3
(3) InChIKey: MSCCTZZBYHQMQJ-UHFFFAOYAV

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
mouse	LD50	intramuscular	> 1gm/kg (1000mg/kg)	Drugs in Japan Vol. 6, Pg. 508, 1982.
mouse	LD50	intraperitoneal	> 10gm/kg (10000mg/kg)	Yaoxue Tongbao. Bulletin of Pharmacology. Vol. 18, Pg. 97, 1983.
mouse	LD50	intravenous	> 1gm/kg (1000mg/kg)	Drugs in Japan Vol. 6, Pg. 508, 1982.
mouse	LD50	oral	> 20gm/kg (20000mg/kg)	Drugs in Japan Vol. 6, Pg. 508, 1982.
mouse	LD50	subcutaneous	> 20gm/kg (20000mg/kg)	Drugs in Japan Vol. 6, Pg. 508, 1982.
rat	LD50	intramuscular	> 1gm/kg (1000mg/kg)	Drugs in Japan Vol. 6, Pg. 508, 1982.
rat	LD50	intravenous	> 250mg/kg (250mg/kg)	Drugs in Japan Vol. 6, Pg. 508, 1982.
rat	LD50	oral	> 15gm/kg (15000mg/kg)	Drugs in Japan Vol. 6, Pg. 508, 1982.
rat	LD50	subcutaneous	> 10gm/kg (10000mg/kg)	Drugs in Japan Vol. 6, Pg. 508, 1982.