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Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
4
Total Number of Articles : 2
|
| PubChem |
7635
|
| Molecular Formula |
C10H20O2 |
| SMILES |
CCCCC(CC)COC(=O)C |
| InChI |
InChI=1S/C10H20O2/c1-4-6-7-10(5-2)8-12-9(3)11/h10H,4-8H2,1-3H3 |
| synonyms |
- 2-ETHYLHEXYL ACETATE
- 103-09-3
- Acetic acid, 2-ethylhexyl ester
- 2-Ethyl-1-hexanol acetate
- 2-Ethyl-1-hexyl acetate
- 2-Ethylhexyl ethanoate
- 2-Ethylhexanyl acetate
- ethylhexyl acetate
- Acetic Acid 2-Ethylhexyl Ester
- 2-Ethylhexylester kyseliny octove
- .beta.-ethylhexyl acetate
- NSC 8897
- 2C7K8OA8SB
- DTXSID8026694
- CHEBI:87392
- NSC-8897
- 2-ethylhexylacetate
- DTXCID106694
- beta-Ethylhexyl acetate
- FEMA Number 2806
- Acetic acid alpha-ethylhexyl ester
- 2EH Acetate
- CAS-103-09-3
- HSDB 2668
- EINECS 203-079-1
- UNII-2C7K8OA8SB
- BRN 1758321
- 2-Ethylhexylester kyseliny octove [Czech]
- AI3-07924
- Ethyl(2)-hexyl acetate
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|
| Properties |
| Property |
Value |
| MW |
172.26 g/mol |
| HBD |
0 |
| HBA |
2 |
| Rotatable Bond Count |
7 |
| Exact Mass |
172.146329876 g/mol |
| Monoisotopic Mass |
172.146329876 g/mol |
| Heavy Atom Count |
12 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
1 |
| Covalent Unit Count |
1 |
| Complexity |
121 |
| xlogp |
3.2 |
| Topological Polar Surface Area |
26.3 |
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