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76470-45-6 | 1,3-DIOXOLO[4,5-B]PYRIDINE-6-CARBOXALDEHYDE
CAS No: 76470-45-6 Catalog No: AG008Q7A MDL No:MFCD13181529
Product Description
Catalog Number:
AG008Q7A
Chemical Name:
1,3-DIOXOLO[4,5-B]PYRIDINE-6-CARBOXALDEHYDE
CAS Number:
76470-45-6
Molecular Formula:
C7H5NO3
Molecular Weight:
151.1195
MDL Number:
MFCD13181529
IUPAC Name:
[1,3]dioxolo[4,5-b]pyridine-6-carbaldehyde
InChI:
InChI=1S/C7H5NO3/c9-3-5-1-6-7(8-2-5)11-4-10-6/h1-3H,4H2
InChI Key:
KZYWCEWLUVVEBR-UHFFFAOYSA-N
SMILES:
O=Cc1cnc2c(c1)OCO2
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.027g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.121g/mol
Monoisotopic Mass:
151.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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