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775294-96-7 | 3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)benzaldehyde
CAS No: 775294-96-7 Catalog No: AG019Q11 MDL No:MFCD06634952
Product Description
Catalog Number:
AG019Q11
Chemical Name:
3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)benzaldehyde
CAS Number:
775294-96-7
Molecular Formula:
C14H12BrNO3
Molecular Weight:
322.1540
MDL Number:
MFCD06634952
IUPAC Name:
3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)benzaldehyde
InChI:
InChI=1S/C14H12BrNO3/c1-18-13-6-11(8-17)5-12(15)14(13)19-9-10-3-2-4-16-7-10/h2-8H,9H2,1H3
InChI Key:
DVTUGDKHDMLLCY-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)c(c(c1)OC)OCc1cccnc1
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.158g/mol
Monoisotopic Mass:
321g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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