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2059974-37-5 | 1-methyl-3-(pyridin-3-yl)-1H-pyrrole-2-carbaldehyde
CAS No: 2059974-37-5 Catalog No: AG01BPAC MDL No:MFCD30500016
Product Description
Catalog Number:
AG01BPAC
Chemical Name:
1-methyl-3-(pyridin-3-yl)-1H-pyrrole-2-carbaldehyde
CAS Number:
2059974-37-5
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD30500016
IUPAC Name:
1-methyl-3-pyridin-3-ylpyrrole-2-carbaldehyde
InChI:
InChI=1S/C11H10N2O/c1-13-6-4-10(11(13)8-14)9-3-2-5-12-7-9/h2-8H,1H3
InChI Key:
HLQIWAULSWXDMT-UHFFFAOYSA-N
SMILES:
O=Cc1n(C)ccc1c1cccnc1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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