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Home > Aldehydes > 188745-48-4
188745-48-4 | 5H-1,3-Dioxolo[4,5-c]pyrrole-5-carboxaldehyde
CAS No: 188745-48-4 Catalog No: AG002H9J MDL No:
Product Description
Catalog Number:
AG002H9J
Chemical Name:
5H-1,3-Dioxolo[4,5-c]pyrrole-5-carboxaldehyde
CAS Number:
188745-48-4
Molecular Formula:
C6H5NO3
Molecular Weight:
139.1088
IUPAC Name:
[1,3]dioxolo[4,5-c]pyrrole-5-carbaldehyde
InChI:
InChI=1S/C6H5NO3/c8-3-7-1-5-6(2-7)10-4-9-5/h1-3H,4H2
InChI Key:
YYYGSVGCYBRKLL-UHFFFAOYSA-N
SMILES:
O=Cn1cc2c(c1)OCO2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.027g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.11g/mol
Monoisotopic Mass:
139.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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