2,5-Bis(hexyloxy)terephthalaldehyde - CAS 151903-52-5
Catalog:
BB047283
Product Name:
2,5-Bis(hexyloxy)terephthalaldehyde
CAS:
151903-52-5
Synonyms:
1,4-Benzenedicarboxaldehyde, 2,5-bis(hexyloxy)-
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BB047283
100 mg
$199
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IUPAC Name: 2,5-dihexoxyterephthalaldehyde
Description: 2,5-Bis(hexyloxy)terephthalaldehyde (CAS# 151903-52-5 ) is a useful research chemical.
Molecular Weight: 334.45
Molecular Formula: C20H30O4
Canonical SMILES: CCCCCCOC1=CC(=C(C=C1C=O)OCCCCCC)C=O
InChI: InChI=1S/C20H30O4/c1-3-5-7-9-11-23-19-13-18(16-22)20(14-17(19)15-21)24-12-10-8-6-4-2/h13-16H,3-12H2,1-2H3
InChI Key: QNZNMVAGYIDUKL-UHFFFAOYSA-N
Purity: 98 %
GHS Hazard Statement: H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement: P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word: Warning
Complexity: 300
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 334.21440943
Formal Charge: 0
Heavy Atom Count: 24
Hydrogen Bond Acceptor Count: 4
Hydrogen Bond Donor Count: 0
Isotope Atom Count: 0
Monoisotopic Mass: 334.21440943
Rotatable Bond Count: 14
Topological Polar Surface Area: 52.6
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 5.5
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