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308088-29-1

308088-29-1 | Benzaldehyde, 4-(acetyloxy)-3-bromo-5-methoxy-

CAS No: 308088-29-1 Catalog No: AG0031CC MDL No:MFCD02090077

Product Description

Catalog Number:
AG0031CC
Chemical Name:
Benzaldehyde, 4-(acetyloxy)-3-bromo-5-methoxy-
CAS Number:
308088-29-1
Molecular Formula:
C10H9BrO4
Molecular Weight:
273.0801
MDL Number:
MFCD02090077
IUPAC Name:
(2-bromo-4-formyl-6-methoxyphenyl) acetate
InChI:
InChI=1S/C10H9BrO4/c1-6(13)15-10-8(11)3-7(5-12)4-9(10)14-2/h3-5H,1-2H3
InChI Key:
SXSITNPVULYEFB-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)c(c(c1)OC)OC(=O)C

Properties

Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.968g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.082g/mol
Monoisotopic Mass:
271.968g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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