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- Hexadecanoic acid,1,1',1''-(1,2,3-propanetriyl) ester
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- 94247-53-74-Cyclohexyl hydrogen 2-octadecenylsuccinate
- 94247-55-94-(3-Methylcyclohexyl) hydrogen 2-octadecenylsuccinate
- 94247-61-7Naphthalene,sec-octadecyl- (9CI)
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| Name |
Hexadecanoic acid, isononyl ester(9CI) |
EINECS | 304-175-7 |
| CAS No. | 94247-00-4 | Density | N/A |
| PSA | 26.30000 | LogP | 8.61740 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C25H50O2 | Boiling Point | N/A |
| Molecular Weight | 382.6633 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Isononyl palmitate; |
Hexadecanoic acid, isononyl ester(9CI) Specification
The Hexadecanoic acid, isononyl ester(9CI), with the CAS registry number 94247-00-4, is also known as Isononyl palmitate. Its EINECS registry number is 304-175-7. This chemical's molecular formula is C25H50O2 and molecular weight is 382.6633. Its IUPAC name is called 7-methyloctyl hexadecanoate.
Physical properties of Hexadecanoic acid, isononyl ester(9CI): (1)XLogP3-AA: 11.1; (2)H-Bond Donor: 0; (3)H-Bond Acceptor: 2; (4)Rotatable Bond Count: 22; (5)Exact Mass: 382.381081; (6)MonoIsotopic Mass: 382.381081; (7)Topological Polar Surface Area: 26.3; (8)Heavy Atom Count: 27; (9)Formal Charge: 0; (10)Complexity: 299; (11)Covalently-Bonded Unit Count: 1.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCCCCCCCCCC(=O)OCCCCCCC(C)C
(2)InChI: InChI=1S/C25H50O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(26)27-23-20-17-16-18-21-24(2)3/h24H,4-23H2,1-3H3
(3)InChIKey: UBGYURICIGUKHC-UHFFFAOYSA-N
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