Home Other Building Blocks 6-(BENZYLOXY)NICOTINALDEHYDE

6-(BENZYLOXY)NICOTINALDEHYDE

CAS No.:
635712-99-1
Catalog Number:
AG00EIJ8
Molecular Formula:
C13H11NO2
Molecular Weight:
213.2319
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Product Description
Catalog Number:
AG00EIJ8
Chemical Name:
6-(BENZYLOXY)NICOTINALDEHYDE
CAS Number:
635712-99-1
Molecular Formula:
C13H11NO2
Molecular Weight:
213.2319
MDL Number:
MFCD10697656
IUPAC Name:
6-phenylmethoxypyridine-3-carbaldehyde
InChI:
InChI=1S/C13H11NO2/c15-9-12-6-7-13(14-8-12)16-10-11-4-2-1-3-5-11/h1-9H,10H2
InChI Key:
BBTGUOBUBJNAGS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(nc1)OCc1ccccc1
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.079g/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:
2.1  
Properties