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114483-63-5 | 2-(PYRIDIN-3-YLMETHOXY)-BENZALDEHYDE
CAS No: 114483-63-5 Catalog No: AG008SAS MDL No:MFCD08056100
Product Description
Catalog Number:
AG008SAS
Chemical Name:
2-(PYRIDIN-3-YLMETHOXY)-BENZALDEHYDE
CAS Number:
114483-63-5
Molecular Formula:
C13H11NO2
Molecular Weight:
213.2319
MDL Number:
MFCD08056100
IUPAC Name:
2-(pyridin-3-ylmethoxy)benzaldehyde
InChI:
InChI=1S/C13H11NO2/c15-9-12-5-1-2-6-13(12)16-10-11-4-3-7-14-8-11/h1-9H,10H2
InChI Key:
NSLNYNOSOATOMH-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1OCc1cccnc1
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.236g/mol
Monoisotopic Mass:
213.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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