Home Halogens 4-(4-bromo-3-formylphenoxy)Benzonitrile

4-(4-bromo-3-formylphenoxy)Benzonitrile

CAS No.:
906673-54-9
Catalog Number:
AG0039DS
Molecular Formula:
C14H8BrNO2
Molecular Weight:
302.1228
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Product Description
Catalog Number:
AG0039DS
Chemical Name:
4-(4-bromo-3-formylphenoxy)Benzonitrile
CAS Number:
906673-54-9
Molecular Formula:
C14H8BrNO2
Molecular Weight:
302.1228
MDL Number:
MFCD23131224
IUPAC Name:
4-(4-bromo-3-formylphenoxy)benzonitrile
InChI:
InChI=1S/C14H8BrNO2/c15-14-6-5-13(7-11(14)9-17)18-12-3-1-10(8-16)2-4-12/h1-7,9H
InChI Key:
IEHZPKWXBVTRRG-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1Br)Oc1ccc(cc1)C#N
EC Number:
822-547-1
Properties
Complexity:
330  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.974g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.127g/mol
Monoisotopic Mass:
300.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties