1,3-Benzodioxole-4-carboxaldehyde


Chemical Name: 1,3-Benzodioxole-4-carboxaldehyde
CAS Number: 7797-83-3
Product Number: AG003O1V(AGN-PC-0JLTS3)
Synonyms:
MDL No:
Molecular Formula: C8H6O3
Molecular Weight: 150.1314

Identification/Properties


Properties
MP:
34-36°C(lit.)
BP:
80°C at 0.3mmHg(lit.)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4500 (estimate)
Computed Properties
Molecular Weight:
150.133g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
150.032g/mol
Monoisotopic Mass:
150.032g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
157
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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