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95849-26-6 | 2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-7-carbaldehyde
CAS No: 95849-26-6 Catalog No: AG006ARR MDL No:MFCD12755734
Product Description
Catalog Number:
AG006ARR
Chemical Name:
2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-7-carbaldehyde
CAS Number:
95849-26-6
Molecular Formula:
C8H7NO3
Molecular Weight:
165.1461
MDL Number:
MFCD12755734
IUPAC Name:
2,3-dihydro-[1,4]dioxino[2,3-b]pyridine-7-carbaldehyde
InChI:
InChI=1S/C8H7NO3/c10-5-6-3-7-8(9-4-6)12-2-1-11-7/h3-5H,1-2H2
InChI Key:
OZNRIAMVJSYDHX-UHFFFAOYSA-N
SMILES:
O=Cc1cnc2c(c1)OCCO2
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.148g/mol
Monoisotopic Mass:
165.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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