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Home > Aldehydes > 1167056-60-1
1167056-60-1 | 1H-Pyrrolo[2,3-c]pyridine-3-carboxaldehyde, 5,7-dichloro-
CAS No: 1167056-60-1 Catalog No: AG000D3Y MDL No:
Product Description
Catalog Number:
AG000D3Y
Chemical Name:
1H-Pyrrolo[2,3-c]pyridine-3-carboxaldehyde, 5,7-dichloro-
CAS Number:
1167056-60-1
Molecular Formula:
C8H4Cl2N2O
Molecular Weight:
215.0362
IUPAC Name:
5,7-dichloro-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde
InChI:
InChI=1S/C8H4Cl2N2O/c9-6-1-5-4(3-13)2-11-7(5)8(10)12-6/h1-3,11H
InChI Key:
TYAALXRKDYAAMQ-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1cc(Cl)nc2Cl
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.97g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.033g/mol
Monoisotopic Mass:
213.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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