Isobornyl propionate

PubChem CID: 23617864

Connections displayed (default: 10).

Loading graph...

ℹ️ Click here to know more about the properties

Compound Synonyms	Isobornyl propanoate, 2756-56-1, Isobornyl propionate, Isoborneol, propionate, FEMA No. 2163, 2-Bornyl propionate, exo-, 7T3RQY66IC, 2-Camphanyl propionate, exo-, iso-Bornyl Propionate, Exo-2-Bornyl propionate, EINECS 220-410-5, NSC 67993, Exo-2-Camphanyl propionate, AI3-04363, Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, propanoate, exo-, ISOBORNYL PROPIONATE [FHFI], [(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] propanoate, Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, 2-propanoate, (1R,2R,4R)-rel-, Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, propanoate, (1R,2R,4R)-rel-, NSC-67993, PROPIONIC ACID, ISOBORNYL ESTER, 1,7,7-Trimethylbicyclo(2.2.1)heptan-2-yl propanoate, exo-, exo-1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl propionate, Exo-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl propionate, Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, propanoate, (1R,2R,4R)-rel-, so-Bornyl n-propionate, iso-Bornyl n-propionate, Isoborneol, propionate (8CI), UNII-7T3RQY66IC, DTXSID2042062, FEMA 2163, Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, 2-propanoate, (1R,2R,4R)-rel-, Isobornyl propionic acid, Bornyl (iso) propionate, 1,7,7-trimethylbicyclo(2.2.1)heptan-2-yl propanoate, Exo-1,7,7-Trimethylbicyclo(2.2.1)heptan-2-yl propanoate, 1,7,7-TRIMETHYLBICYCLO[2.2.1]HEPTAN-2-YL PROPANOATE, CHEMBL3187995, DTXCID0022062, FAFMZORPAAGQFV-BREBYQMCSA-N, (+/-)-ISOBORNYL PROPIONATE, Tox21_301344, ISOBORNYL PROPIONATE, (+/-)-, NCGC00255923-01, CAS-2756-56-1, Q27268818, Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, propanoate, exo-(9CI)
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0.0
Heavy Atom Count	15.0
Isotope Atom Count	0.0
Molecular Complexity	282.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	3.0
Uniprot Id	P05412
Iupac Name	[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] propanoate
Prediction Hob	1.0
Xlogp	3.8
Molecular Formula	C13H22O2
Prediction Swissadme	1.0
Inchi Key	FAFMZORPAAGQFV-BREBYQMCSA-N
Fcsp3	0.9230769230769232
Logs	-4.253
Rotatable Bond Count	3.0
Logd	3.615
Compound Name	Isobornyl propionate
Prediction Hob Swissadme	1.0
Exact Mass	210.162
Formal Charge	0.0
Monoisotopic Mass	210.162
Hydrogen Bond Acceptor Count	2.0
Molecular Weight	210.31
Covalent Unit Count	1.0
Total Atom Stereocenter Count	3.0
Total Bond Stereocenter Count	0.0
Esol	-3.9510653999999996
Inchi	InChI=1S/C13H22O2/c1-5-11(14)15-10-8-9-6-7-13(10,4)12(9,2)3/h9-10H,5-8H2,1-4H3/t9-,10-,13+/m1/s1
Smiles	CCC(=O)O[C@@H]1C[C@H]2CC[C@@]1(C2(C)C)C
Nring	2.0
Defined Bond Stereocenter Count	0.0

1. Outgoing r'ship FOUND_IN to/from Abutilon Indicum (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Arthrocnemum Indicum (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Bryodesma Indicum (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Canarium Indicum (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Cerastium Indicum (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Chrysanthellum Indicum (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Chrysanthemum Boreale (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Chrysanthemum Coronarium (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Chrysanthemum Griffithii (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Chrysanthemum Indicum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
11. Outgoing r'ship FOUND_IN to/from Chrysanthemum Lavandulifolium (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Chrysanthemum Leptophyllum (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Chrysanthemum Morifolium (Plant) Rel Props:Source_db:npass_chem_all
14. Outgoing r'ship FOUND_IN to/from Chrysanthemum Myconis (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Chrysanthemum Pyrethroides (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Chrysanthemum Sinense (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Chrysanthemum Tibeticum (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Chrysanthemum Uliginosum (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Chrysanthemum X (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Chrysanthemum Zawadskii (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Claoxylon Indicum (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Clerodendron Indicum (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Clerodendrum Indicum (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Combretum Indicum (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Distemon Indicum (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Gnaphalium Indicum (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Gossypium Indicum (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Heliophylum Indicum (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Heliotropium Indicum (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Jasminum Chrysanthemum (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Limeum Indicum (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Limnanthemum Indicum (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Melanthium Indicum (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Melilotus Indicum (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Nasturtium Indicum (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Nerium Indicum (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Nymphoides Indicum (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Oroxylum Indicum (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Pentanema Indicum (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Phyllocephalum Indicum (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Poeciloneuron Indicum (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Sandoricum Indicum (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Sapium Indicum (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Sesamum Indicum (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Seseli Indicum (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Solanum Indicum (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Tiaridium Indicum (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Trichodesma Indicum (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Tricodesma Indicum (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Xanthium Indicum (Plant) Rel Props:Reference:

Back to Browse Back to Home

GRAYU Website

Grayu

Isobornyl propionate

Graph

Phytochemical Properties

Associated Connections 50

Plant Connections 50