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1204-21-3

1204-21-3 | 2-Bromo-2,5-Dimethoxyacetophenone

CAS No: 1204-21-3 Catalog No: AG003B6A MDL No:MFCD00000198

Product Description

Catalog Number:
AG003B6A
Chemical Name:
2-Bromo-2,5-Dimethoxyacetophenone
CAS Number:
1204-21-3
Molecular Formula:
C10H11BrO3
Molecular Weight:
259.0965
MDL Number:
MFCD00000198
IUPAC Name:
2-bromo-1-(2,5-dimethoxyphenyl)ethanone
InChI:
InChI=1S/C10H11BrO3/c1-13-7-3-4-10(14-2)8(5-7)9(12)6-11/h3-5H,6H2,1-2H3
InChI Key:
RGQNFYVSEWDUEI-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C(=O)CBr)OC
EC Number:
214-873-2
UNII:
XV6ER0C1DT

Properties

Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.989g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.099g/mol
Monoisotopic Mass:
257.989g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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