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Home > Aldehydes > 186801-36-5
186801-36-5 | 1-PYRIDIN-3-YLMETHYL-1H-PYRROLE-2-CARBALDEHYDE
CAS No: 186801-36-5 Catalog No: AG00AOPO MDL No:MFCD02665151
Product Description
Catalog Number:
AG00AOPO
Chemical Name:
1-PYRIDIN-3-YLMETHYL-1H-PYRROLE-2-CARBALDEHYDE
CAS Number:
186801-36-5
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD02665151
IUPAC Name:
1-(pyridin-3-ylmethyl)pyrrole-2-carbaldehyde
InChI:
InChI=1S/C11H10N2O/c14-9-11-4-2-6-13(11)8-10-3-1-5-12-7-10/h1-7,9H,8H2
InChI Key:
RUHXZRGZYVDLFT-UHFFFAOYSA-N
SMILES:
O=Cc1cccn1Cc1cccnc1
Properties
Complexity:
196
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:
3
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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