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Home > Aldehydes > 1086378-94-0
1086378-94-0 | 3-[(2-Chloropyrimidin-4-yl)oxy]benzaldehyde
CAS No: 1086378-94-0 Catalog No: AG01FATL MDL No:
Product Description
Catalog Number:
AG01FATL
Chemical Name:
3-[(2-Chloropyrimidin-4-yl)oxy]benzaldehyde
CAS Number:
1086378-94-0
Molecular Formula:
C11H7ClN2O2
Molecular Weight:
234.6385
IUPAC Name:
3-(2-chloropyrimidin-4-yl)oxybenzaldehyde
InChI:
InChI=1S/C11H7ClN2O2/c12-11-13-5-4-10(14-11)16-9-3-1-2-8(6-9)7-15/h1-7H
InChI Key:
VAMZQCOWTSWLQN-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)Oc1ccnc(n1)Cl
Properties
Complexity:
240
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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