Home Halogens 4-bromo-2-methyl-1-benzofuran-7-carboxylic acid

4-bromo-2-methyl-1-benzofuran-7-carboxylic acid

CAS No.:
1797928-84-7
Catalog Number:
AG01AFRD
Molecular Formula:
C10H7BrO3
Molecular Weight:
255.0648
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Product Description
Catalog Number:
AG01AFRD
Chemical Name:
4-bromo-2-methyl-1-benzofuran-7-carboxylic acid
CAS Number:
1797928-84-7
Molecular Formula:
C10H7BrO3
Molecular Weight:
255.0648
MDL Number:
MFCD27959362
IUPAC Name:
4-bromo-2-methyl-1-benzofuran-7-carboxylic acid
InChI:
InChI=1S/C10H7BrO3/c1-5-4-7-8(11)3-2-6(10(12)13)9(7)14-5/h2-4H,1H3,(H,12,13)
InChI Key:
WLSSAROQVAPOJR-UHFFFAOYSA-N
SMILES:
Cc1cc2c(o1)c(ccc2Br)C(=O)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.958g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.067g/mol
Monoisotopic Mass:
253.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties