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18870-77-4

18870-77-4 structural image
Product Name: Pyrrole-3-carboxaldehyde, 1-isopropyl-2,5-dimethyl- (8CI)
Formula: C10H15NO
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 23 [ug/mL] (The mean of the results at pH 7.4)

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 165.23 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 165.115364102 g/mol
Monoisotopic Mass 165.115364102 g/mol
Topological Polar Surface Area 22 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 167
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes