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172685-68-6

172685-68-6 | 2-[(3-BROMOBENZYL)OXY]BENZALDEHYDE

CAS No: 172685-68-6 Catalog No: AG007VPF MDL No:MFCD00553743

Product Description

Catalog Number:
AG007VPF
Chemical Name:
2-[(3-BROMOBENZYL)OXY]BENZALDEHYDE
CAS Number:
172685-68-6
Molecular Formula:
C14H11BrO2
Molecular Weight:
291.1399
MDL Number:
MFCD00553743
IUPAC Name:
2-[(3-bromophenyl)methoxy]benzaldehyde
InChI:
InChI=1S/C14H11BrO2/c15-13-6-3-4-11(8-13)10-17-14-7-2-1-5-12(14)9-16/h1-9H,10H2
InChI Key:
YASCLTFMVVWLAN-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1OCc1cccc(c1)Br

Properties

Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.994g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.144g/mol
Monoisotopic Mass:
289.994g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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