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56795-92-7 | 5-(Benzyloxy);-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde
CAS No: 56795-92-7 Catalog No: AG003M6V MDL No:MFCD00191784
Product Description
Catalog Number:
AG003M6V
Chemical Name:
5-(Benzyloxy);-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde
CAS Number:
56795-92-7
Molecular Formula:
C15H12N2O2
Molecular Weight:
252.2680
MDL Number:
MFCD00191784
IUPAC Name:
5-phenylmethoxy-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde
InChI:
InChI=1S/C15H12N2O2/c18-9-12-7-16-14-8-17-15(6-13(12)14)19-10-11-4-2-1-3-5-11/h1-9,16H,10H2
InChI Key:
OZWLZROTVDCROC-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1cc(OCc1ccccc1)nc2
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.273g/mol
Monoisotopic Mass:
252.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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