7,9-Decadienoicacid, butyl ester supplier

Name
n - butyl (E) - 7,9 - decadienoate
EINECS
CAS No. 927636-54-2
Density 0.890±0.06 g/cm3(Predicted)
Solubility
Melting Point
Formula C₁₄H₂₄O₂
Boiling Point 295.7±19.0 °C(Predicted)
Molecular Weight 224.33916
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms n-Butyl (E)-7,9-decadienoate;
PSA 26.30000
LogP 4.02240

7,9-Decadienoicacid, butyl ester Specification

The 7,9-Decadienoicacid, butyl ester, with the CAS registry number 927636-54-2, is also known as n-Butyl (E)-7,9-decadienoate. This chemical's molecular formula is C₁₄H₂₄O₂ and molecular weight is 224.33916. Its IUPAC name is called butyl (7E)-deca-7,9-dienoate.

Physical properties of 7,9-Decadienoicacid, butyl ester: (1)XLogP3-AA: 4.5; (2)H-Bond Donor: 0; (3)H-Bond Acceptor: 2; (4)Rotatable Bond Count: 11; (5)Exact Mass: 224.17763; (6)MonoIsotopic Mass: 224.17763; (7)Topological Polar Surface Area: 26.3; (8)Heavy Atom Count: 16; (9)Formal Charge: 0; (10)Complexity: 207; (11)Covalently-Bonded Unit Count: 1; (12)Feature 3D Acceptor Count: 1; (13)Feature 3D Hydrophobe Count: 4; (14)Effective Rotor Count: 11; (15)Conformer Sampling RMSD: 1.2; (16)CID Conformer Count: 60.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCOC(=O)CCCCCC=CC=C
(2)Isomeric SMILES: CCCCOC(=O)CCCCC/C=C/C=C
(3)InChI: InChI=1S/C14H24O2/c1-3-5-7-8-9-10-11-12-14(15)16-13-6-4-2/h3,5,7H,1,4,6,8-13H2,2H3/b7-5+
(4)InChIKey: IAJMFWMUVKHKLG-FNORWQNLSA-N

Product Name

n - butyl (E) - 7,9 - decadienoate

7,9-Decadienoicacid, butyl ester Specification

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