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Home > Aldehydes > 1086378-89-3
1086378-89-3 | 4-[(2-Chloropyrimidin-4-yl)oxy]benzaldehyde
CAS No: 1086378-89-3 Catalog No: AG01FATK MDL No:
Product Description
Catalog Number:
AG01FATK
Chemical Name:
4-[(2-Chloropyrimidin-4-yl)oxy]benzaldehyde
CAS Number:
1086378-89-3
Molecular Formula:
C11H7ClN2O2
Molecular Weight:
234.6385
IUPAC Name:
4-(2-chloropyrimidin-4-yl)oxybenzaldehyde
InChI:
InChI=1S/C11H7ClN2O2/c12-11-13-6-5-10(14-11)16-9-3-1-8(7-15)2-4-9/h1-7H
InChI Key:
VDKYAXSPQPTVOF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)Oc1ccnc(n1)Cl
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.02g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.639g/mol
Monoisotopic Mass:
234.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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