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57543-36-9

57543-36-9 | 5-BROMO-2-HYDROXY-4-METHOXYBENZALDEHYDE

CAS No: 57543-36-9 Catalog No: AG003MH7 MDL No:MFCD00839421

Product Description

Catalog Number:
AG003MH7
Chemical Name:
5-BROMO-2-HYDROXY-4-METHOXYBENZALDEHYDE
CAS Number:
57543-36-9
Molecular Formula:
C8H7BrO3
Molecular Weight:
231.0434
MDL Number:
MFCD00839421
IUPAC Name:
5-bromo-2-hydroxy-4-methoxybenzaldehyde
InChI:
InChI=1S/C8H7BrO3/c1-12-8-3-7(11)5(4-10)2-6(8)9/h2-4,11H,1H3
InChI Key:
OHSSWZLKWHLYFP-UHFFFAOYSA-N
SMILES:
COc1cc(O)c(cc1Br)C=O

Properties

Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.958g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.045g/mol
Monoisotopic Mass:
229.958g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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