3-Benzofurancarboxaldehyde, 2-methyl-


Chemical Name: 3-Benzofurancarboxaldehyde, 2-methyl-
CAS Number: 55581-61-8
Product Number: AG00DO5D(AGN-PC-0JTH5N)
Synonyms:
MDL No:
Molecular Formula: C10H8O2
Molecular Weight: 160.1693

Identification/Properties


Computed Properties
Molecular Weight:
160.172g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
160.052g/mol
Monoisotopic Mass:
160.052g/mol
Topological Polar Surface Area:
30.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
179
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:
Danger
UN#:
2811
Hazard Statements:
H301
Precautionary Statements:
P264-P270-P301+P310+P330-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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