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80863-62-3

Basic Information
CAS No.: 80863-62-3
Name: Alitame
Molecular Structure:
Molecular Structure of 80863-62-3 (Alitame)
Formula: C14H25N3O4S
Molecular Weight: 331.436
Synonyms: Thietane,D-alaninamide deriv.;Alitame;CP 54802;
EINECS: 1312995-182-4
Density: 1.25g/cm3
Melting Point: 136-147°
Boiling Point: 608.5oC at 760 mmHg
Flash Point: 321.8oC
PSA: 146.82000
LogP: 1.56400
Synthetic route
80863-62-3

3-(L-Aspartyl-D-alaninamido)-2,2,4,4-tetramethylthietane

104-15-4

toluene-4-sulfonic acid

3-L-α-aspartyl-D-alanylamido-2,2,4,4-tetramethylthietanylamine p-toluenesulfonate

Conditions
ConditionsYield
Stage #1: 3-(L-Aspartyl-D-alaninamido)-2,2,4,4-tetramethylthietane With hydrogenchloride In water for 18h; pH=3.0;
Stage #2: toluene-4-sulfonic acid In water Product distribution / selectivity;
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  • Casno:

    80863-62-3

    Alitame

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    ISO/factory/goodqualityAppearance:off white Storage:Dry,cool place Package:drum Application:active pharmaceutical ingredients Transportation:by air/sea/express Port:shenzhen/shanghai

    Wuhan Vanz Pharm Inc. is a manufacturer&trading company.

  •  Hubei Vanz Pharm Co.,Ltd

     China (Mainland)  |  Contact Details

    Business Type:Manufacturers

    Tel:86-27-84492310

    Address:FANHU INDUSTRY PARK

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  • Alitame

  • Casno:

    80863-62-3

    Alitame

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    FOB Price:  USD $ 0.0-0.0

    Lower price, sample is available,SDS test documents are available,large stock in warehouseAppearance:White powder Storage:Sealed and preserved Package:200/Kilograms Application:Fine chemical intermediates, used as the main raw material for the synthe

    GIHI CHEMICALS CO.,LIMITED, its former company is a small manufacturer who is specialized in the production of ester products which are used in the daily chemicals ,cosmetic produc

  •  GIHI CHEMICALS CO.,LIMITED

     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:+86-571-86217390

    Address:No.567 Dengcai Street,Sandun,Westlake District,Hangzhou310030,Zhejiang,China.

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  • Aclame CAS 80863-62-3

  • Casno:

    80863-62-3

    Aclame CAS 80863-62-3

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    1.A strong technical force and advanced processing equipments. The quality of the products has been strictly inspected and all kinds of index have reached or exceeded domestic and international standards.2. Now we have established long-term stable re

    Wuxi TAA Chemical Industry Co.,Ltd., established in 2010, is a key chemical manufacturer and supplier in China. In 2010, three young chemists from a local large state-owned chemi

  •  Wuxi TAA Chemical Industry Co.,LTD.

     China (Mainland)  |  Contact Details

    Business Type:Other

    Tel:18168326835

    Address:2202 Scientific Research Business Center, Lihu Road, Wuxi 214128 China

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  • Aclame CAS 80863-62-3

  • Casno:

    80863-62-3

    Aclame CAS 80863-62-3

    Min.Order: 0 Metric Ton

    FOB Price:  USD $ 0.0-0.0

    Name: Aclame CAS: 80863-62-3 Molecular Formula: C14H25N3O4S Molecular Weight: 331.431 Application:Fine chemical

    TNJ is a chemical company since 2001. Our specialization, your confidence-we keep committing to meet the needs of markets and customers with our innovative technology and high stab

  •  Hefei TNJ chemical industry co.,ltd

     China (Mainland)  |  Contact Details

    Business Type:Trading Company

    Tel:+86-551-65418695

    Address:B911 Xincheng Business Center, Qianshan Road, Hefei Anhui China

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  • Aclame

  • Casno:

    80863-62-3

    Aclame

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    TAIHO Unique Advantages:1.We're factory2.Free samples available3.Commodity inspection can be done4.ISO9001,Kosher certifications5.10 years experiences Storage:Store in cool &dry place Package:aluminium foil bag/fiber can/plastic drum Application:comp

    As a member of TAIHO Group,Hubei Taiho Chemical Co.,Ltd,is a professional new-type chemicals enterprise combined into research and development,production and sales.We adhere to the

  •  Hubei Taiho Chemical Co.,LTD

     China (Mainland)  |  Contact Details

    Business Type:Manufacturers

    Tel:+86-18120399543

    Address:No. 49 taifeng Road,Qianjiang City,Hubei,China

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  • Alitame

  • Casno:

    80863-62-3

    Alitame

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    best seller Application:API

    Xi'an Changyue Biotechnology Co., Ltd. was established in October 2003 and is located in Xi'an High-tech Industrial Development Park. It is a company specializing in the extraction

  •  Xian Changyue Biological Technology Co., Ltd.

     China (Mainland)  |  Contact Details

    Business Type:Manufacturers

    Tel:+86-029-62886900

    Address:Keji Road NO.70

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Specification

The Alitame, with the CAS registry number 80863-62-3, is also known as L-alpha-Aspartyl-N-(2,2,4,4-tetramethyl-3-thietanyl)-D-alaninamide. Its molecular formula is C14H25N3O4S and systematic name is L-α-aspartyl-N-(2,2,4,4-tetramethylthietan-3-yl)-D-alaninamide. Additionally, this chemical is white crystalline powder formed from aspartic acid, alanine & an amide. What's more, it has strong sweet taste and it's odorless. Unlike aspartame, alitame does not contain phenylalanine, and can therefore be used by people with phenylketonuria. It's soluble in water (13.1%), ethanol (61%), methanol (41.9%) and glycerol (53.7%), slightly soluble in chloroform. It does not absorb moisture and its heat resistance, acid resistance are good.

Other characteristics of the Alitame can be summarised as followings: (1)ACD/LogP: 1.17; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -1.13; (4)ACD/LogD (pH 7.4): -1.55; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 7; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 95.46 Å2; (13)Index of Refraction: 1.559; (14)Molar Refractivity: 85.59 cm3; (15)Molar Volume: 264.8 cm3; (16)Polarizability: 33.93×
10-24cm3; (17)Surface Tension: 54.2 dyne/cm; (18)Density: 1.25 g/cm3; (19)Flash Point: 321.8 °C; (20)Enthalpy of Vaporization: 98.71 kJ/mol; (21)Boiling Point: 608.5 °C at 760 mmHg; (22)Vapour Pressure: 2.25E-16 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(NC1C(SC1(C)C)(C)C)[C@H](NC(=O)[C@@H](N)CC(=O)O)C
2.InChI: InChI=1/C14H25N3O4S/c1-7(16-11(21)8(15)6-9(18)19)10(20)17-12-13(2,3)22-14(12,4)5/h7-8,12H,6,15H2,1-5H3,(H,16,21)(H,17,20)(H,18,19)/t7-,8+/m1/s1 3.InChIKey: IVBOUFAWPCPFTQ-SFYZADRCBL