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Chemistry

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Also known as: 6938-94-9, Adipic acid diisopropyl ester, Isopropyl adipate, Adipic acid, diisopropyl ester, Dipropan-2-yl hexanedioate, Prodipate
Molecular Formula
C12H22O4
Molecular Weight
230.30  g/mol
InChI Key
ZDQWESQEGGJUCH-UHFFFAOYSA-N
FDA UNII
P7E6YFV72X

Diisopropyl Adipate
1 2D Structure

Diisopropyl Adipate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
dipropan-2-yl hexanedioate
2.1.2 InChI
InChI=1S/C12H22O4/c1-9(2)15-11(13)7-5-6-8-12(14)16-10(3)4/h9-10H,5-8H2,1-4H3
2.1.3 InChI Key
ZDQWESQEGGJUCH-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)OC(=O)CCCCC(=O)OC(C)C
2.2 Other Identifiers
2.2.1 UNII
P7E6YFV72X
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Adipic Acid Diisopropyl Ester

2.3.2 Depositor-Supplied Synonyms

1. 6938-94-9

2. Adipic Acid Diisopropyl Ester

3. Isopropyl Adipate

4. Adipic Acid, Diisopropyl Ester

5. Dipropan-2-yl Hexanedioate

6. Prodipate

7. Ceraphyl 230

8. Crodamol Da

9. Standamul Dipa

10. Hexanedioic Acid, Bis(1-methylethyl) Ester

11. Wickenol 116

12. Beta Dia

13. Schercemol Dia

14. Tegester 504-d

15. Iso-adipate 2/043700

16. 1,6-bis(propan-2-yl) Hexanedioate

17. Nsc 56587

18. Bis(1-methylethyl)hexanedioate

19. Bis(1-methylethyl) Hexanedioate

20. P7e6yfv72x

21. Chebi:34711

22. Hexanedioic Acid, 1,6-bis(1-methylethyl) Ester

23. Nsc-56587

24. Diisopropyl Adipat

25. Einecs 230-072-0

26. Unii-p7e6yfv72x

27. Brn 1785346

28. Diisopropyl Adipat [iupac]

29. Ai3-06066

30. Diisopropyl Ester

31. Unimate Dipa

32. .beta. Dia

33. Di-isopropyl Adipate

34. Mfcd00026391

35. Di-iso-propyl Adipate

36. Adipic Acid Diisopropyl

37. Disopropyl Adipate

38. Diisopropyl Hexanedioate #

39. Dsstox_cid_7641

40. Ec 230-072-0

41. Dsstox_rid_78539

42. Dsstox_gsid_27641

43. Schembl15391

44. Bidd:er0603

45. Ceraphyl 230 [vandf]

46. Chembl3184058

47. Diisopropyl Adipate [ii]

48. Dtxsid5027641

49. Fema No. 4474

50. Wln: 1y1&ov4voy1&1

51. Diisopropyl Adipate [inci]

52. Nsc56587

53. Zinc1687490

54. Tox21_200462

55. Lmfa07010790

56. Stl453777

57. Akos015839638

58. Ncgc00248634-01

59. Ncgc00258016-01

60. Bs-42287

61. Cas-6938-94-9

62. Hexanedioic Acid Bis-(1-methylethyl) Ester

63. A0654

64. Cs-0138054

65. Ft-0624994

66. E81725

67. W-104631

68. Q21705003

69. Z1137991589

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 230.30 g/mol
Molecular Formula C12H22O4
XLogP32.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass230.15180918 g/mol
Monoisotopic Mass230.15180918 g/mol
Topological Polar Surface Area52.6 Ų
Heavy Atom Count16
Formal Charge0
Complexity197
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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MAHARASHTRA.","supplier":"CRODA INTERNATIONAL PLC","supplierCountry":"JAPAN","foreign_port":"OSAKA - KANSAI INT\\'L","customer":"CRODA INTERNATIONAL PLC","customerCountry":"INDIA","quantity":"612.00","actualQuantity":"612","unit":"KGS","unitRateFc":"51.5","totalValueFC":"31835.7","currency":"USD","unitRateINR":"4348.3","date":"09-Jul-2024","totalValueINR":"2661178.27","totalValueInUsd":"31835.7","indian_port":"Bombay Air","hs_no":"29171200","bill_no":"4405148","productDescription":"API","marketType":"REGULATED MARKET","country":"JAPAN","selfForZScoreResived":"Pharma Grade","supplierPort":"OSAKA - KANSAI INT\\'L","supplierAddress":"7-1 NISHI-SHINJUKU 3-CHOME, SHINJUKU-KU,TOKYO,163-1011 JAPAN Tokyo, ,JAPAN JAPAN","customerAddress":"PLOT NO 1\/1 PART TTC INDL AREA"},{"dataSource":"API Import","activeIngredients":"","year":"2024","qtr":"Q3","strtotime":1725474600,"product":"DIISOPROPYL ADIPATE A0654 (25125 ML)","address":"SUITE NO.CS-10,BUILDING 450,GENOME","city":"HYDERABAD,TELANGANA","supplier":"TOKYO CHEMICAL INDUSTRY","supplierCountry":"JAPAN","foreign_port":"TOKYO - NARITA","customer":"TOKYO CHEMICAL INDUSTRY","customerCountry":"INDIA","quantity":"25.13","actualQuantity":"25.125","unit":"LTR","unitRateFc":"42.4","totalValueFC":"1090.5","currency":"USD","unitRateINR":"3637.1","date":"05-Sep-2024","totalValueINR":"91381.86","totalValueInUsd":"1090.5","indian_port":"Hyderabad Air","hs_no":"29171200","bill_no":"5438842","productDescription":"API","marketType":"REGULATED MARKET","country":"JAPAN","selfForZScoreResived":"Pharma Grade","supplierPort":"TOKYO - NARITA","supplierAddress":"8F T-PLUS, 16-12 NIHONBASHI-KODEMMA CHO, CHUO-KU TOKYO 103-0001, JAPAN SDNF Japan","customerAddress":"SUITE NO.CS-10,BUILDING 450,GENOME"},{"dataSource":"API Import","activeIngredients":"","year":"2024","qtr":"Q4","strtotime":1729189800,"product":"15353 DUB DIPA (DIISOPROPYL ADIPATE) (RAW MATERIAL FOR COSMETICS USE)","address":"GROUND FLOOR, CORPORATE ONE","city":"DELHI","supplier":"CETES COSMETICS AG","supplierCountry":"POLAND","foreign_port":"WARSAW","customer":"ORIFLAME INDIA PRIVATE ","customerCountry":"INDIA","quantity":"180.00","actualQuantity":"180","unit":"KGS","unitRateFc":"2011.5","totalValueFC":"4865.4","currency":"INR","unitRateINR":"2271.3","date":"18-Oct-2024","totalValueINR":"408826.4","totalValueInUsd":"4865.4","indian_port":"Delhi Air","hs_no":"29280090","bill_no":"6195086","productDescription":"API","marketType":"REGULATED MARKET","country":"POLAND","selfForZScoreResived":"Pharma Grade","supplierPort":"WARSAW","supplierAddress":"BLEICHEPLATZ 3 CH-8200-SCHAFFHAUSEN ., , SWITZERLAND SDNF SWITZERLAND","customerAddress":"GROUND FLOOR, CORPORATE ONE"}]
16-Jan-2021
18-Oct-2024
KGS
overview
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Average Price (USD/KGS)

Number of Transactions

Total Quantity (KGS)

Total Value (USD)

Quantity (KGS) & Unit rate (USD/KGS) over time

API Imports and Exports

Importing Country Total Quantity
(KGS)
Average Price
(USD/KGS)
Number of Transactions

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