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17288-55-0 | 5-METHOXY-1H-PYRROLO[3,2-B]PYRIDINE-3-CARBALDEHYDE
CAS No: 17288-55-0 Catalog No: AG00B5ZR MDL No:MFCD08448187
Product Description
Catalog Number:
AG00B5ZR
Chemical Name:
5-METHOXY-1H-PYRROLO[3,2-B]PYRIDINE-3-CARBALDEHYDE
CAS Number:
17288-55-0
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD08448187
IUPAC Name:
5-methoxy-1H-pyrrolo[3,2-b]pyridine-3-carbaldehyde
InChI:
InChI=1S/C9H8N2O2/c1-13-8-3-2-7-9(11-8)6(5-12)4-10-7/h2-5,10H,1H3
InChI Key:
ZRLKALRMNIQSGC-UHFFFAOYSA-N
SMILES:
COc1ccc2c(n1)c(C=O)c[nH]2
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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