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Home > Aldehydes > 120980-85-0
120980-85-0 | 2-BENZYLOXY-3-BROMOBENZALDEHYDE
CAS No: 120980-85-0 Catalog No: AG0094OJ MDL No:MFCD09999237
Product Description
Catalog Number:
AG0094OJ
Chemical Name:
2-BENZYLOXY-3-BROMOBENZALDEHYDE
CAS Number:
120980-85-0
Molecular Formula:
C14H11BrO2
Molecular Weight:
291.1399
MDL Number:
MFCD09999237
IUPAC Name:
3-bromo-2-phenylmethoxybenzaldehyde
InChI:
InChI=1S/C14H11BrO2/c15-13-8-4-7-12(9-16)14(13)17-10-11-5-2-1-3-6-11/h1-9H,10H2
InChI Key:
WXCPOOYYSDHTPQ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1OCc1ccccc1)Br
Properties
Complexity:
238
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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