CAS No.30123-17-2,Tianeptine sodium salt Suppliers

Products Categories

Pharmaceutical (823)
Organic Chemicals (68)
Others (35)
Catalyst and Auxiliary (29)
Reagent (5)
Food Additives (4)
Adhesive and Sealant (3)
Agrochemicals (2)
(1)
Materials (1)

Basic Information

Molecular Structure:
CAS No.:	30123-17-2
Name:	Tianeptine sodium salt

Formula:	C₂₁H₂₄ClN₂NaO₄S
Molecular Weight:	458.93
Synonyms:	Heptanoicacid, 7-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-,monosodium salt (9CI);Dibenzo[c,f][1,2]thiazepine, heptanoic acidderiv.;Sodium7-[(3-chloro-6,11-dihydro-6-methyldibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoateS,S-dioxide;Stablon;Tianeptine sodium;
EINECS:	250-059-3
Density:	1.38 g/cm³
Melting Point:	180 °C
Boiling Point:	609.2 °C at 760 mmHg
Flash Point:	322.2 °C
Appearance:	white to yellowish powder
PSA:	97.92000
LogP:	4.39460

Total:244 Page 1 of 7 1 2 3 4 5 6 …7 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 30123-17-2

Specification

The Heptanoic acid,7-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-,sodium salt (1:1), with the CAS registry number 30123-17-2 and EINECS registry number 250-059-3, has the systematic name of sodium 7-[(3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoate. It is a kind of white to yellowish powder, and belongs to the following product categories: Intermediates & Fine Chemicals; Pharmaceuticals. And the molecular formula of the chemical is C₂₁H₂₄ClN₂NaO₄S.

The characteristics of Heptanoic acid,7-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-,sodium salt (1:1) are as followings: (1)ACD/LogP: 2.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.22; (4)ACD/LogD (pH 7.4): 0.02; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.67; (8)ACD/KOC (pH 7.4): 1.7; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 86.3 Å²; (13)Flash Point: 322.2 °C; (14)Enthalpy of Vaporization: 95.15 kJ/mol; (15)Boiling Point: 609.2 °C at 760 mmHg; (16)Vapour Pressure: 1.08E-15 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Na+].[O-]C(=O)CCCCCCNC3c1c(cc(Cl)cc1)S(=O)(=O)N(c2c3cccc2)C
(2)InChI: InChI=1/C21H25ClN2O4S.Na/c1-24-18-9-6-5-8-16(18)21(23-13-7-3-2-4-10-20(25)26)17-12-11-15(22)14-19(17)29(24,27)28;/h5-6,8-9,11-12,14,21,23H,2-4,7,10,13H2,1H3,(H,25,26);/q;+1/p-1
(3)InChIKey: ZLBSUOGMZDXYKE-REWHXWOFAT

Premium Related Products