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72138-73-9 | [1,3]Dioxolo[4,5-b]pyridine
CAS No: 72138-73-9 Catalog No: AG005JTG MDL No:MFCD11656564
Product Description
Catalog Number:
AG005JTG
Chemical Name:
[1,3]Dioxolo[4,5-b]pyridine
CAS Number:
72138-73-9
Molecular Formula:
C6H5NO2
Molecular Weight:
123.1094
MDL Number:
MFCD11656564
IUPAC Name:
[1,3]dioxolo[4,5-b]pyridine
InChI:
InChI=1S/C6H5NO2/c1-2-5-6(7-3-1)9-4-8-5/h1-3H,4H2
InChI Key:
YIIOTOBXQVQGSV-UHFFFAOYSA-N
SMILES:
c1cnc2c(c1)OCO2
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.032g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
123.111g/mol
Monoisotopic Mass:
123.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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