(Z)-9-Dodecen-1-ol acetate - CAS 16974-11-1
Catalog:
BB054030
Product Name:
(Z)-9-Dodecen-1-ol acetate
CAS:
16974-11-1
Synonyms:
(Z)-9-Dodecenyl acetate; 9Z-Dodecenyl acetate; (Z)-Dodec-9-en-1-yl acetate; cis-9-Dodecenyl acetate; 9-Dodecen-1-ol, 1-acetate, (9Z)-; (Z)-1-Acetoxy-9-dodecene; cis-9-Dodecen-1-ol acetate; cis-9-Dodecen-1-yl acetate; (9Z)-Dodecen-1-ol Acetate; (Z)-9-Dodecen-1-yl Acetate; Eupoewit; Grapemone
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BB054030
1 g
$599
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IUPAC Name: [(Z)-dodec-9-enyl] acetate
Molecular Weight: 226.36
Molecular Formula: C14H26O2
Canonical SMILES: CCC=CCCCCCCCCOC(=O)C
InChI: InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h4-5H,3,6-13H2,1-2H3/b5-4-
InChI Key: MFFQOUCMBNXSBK-PLNGDYQASA-N
Boiling Point: 300.1±21.0°C at 760 Torr
Purity: ≥90%
Density: 0.881±0.06 g/cm3 at 20°C, 760 Torr
Solubility: Soluble in Alcohol, Water
Appearance: Colorless to Pale Yellow Clear Liquid
GHS Hazard Statement: H400 (14.68%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]; H410 (94.5%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement: P273, P391, and P501
Signal Word: Warning
Complexity: 185
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 1
Exact Mass: 226.193280068
Formal Charge: 0
Heavy Atom Count: 16
Hydrogen Bond Acceptor Count: 2
Hydrogen Bond Donor Count: 0
Isotope Atom Count: 0
Monoisotopic Mass: 226.193280068
Rotatable Bond Count: 11
Topological Polar Surface Area: 26.3
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 4.8
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