200,000+ products from a single source!
sales@angenechem.com
88791-16-6 | 4-Bromo-7-methoxybenzo[b]thiophene-2-carboxylic acid
CAS No: 88791-16-6 Catalog No: AG004CYD MDL No:
Product Description
Catalog Number:
AG004CYD
Chemical Name:
4-Bromo-7-methoxybenzo[b]thiophene-2-carboxylic acid
CAS Number:
88791-16-6
Molecular Formula:
C10H7BrO3S
Molecular Weight:
287.1298
IUPAC Name:
4-bromo-7-methoxy-1-benzothiophene-2-carboxylic acid
InChI:
InChI=1S/C10H7BrO3S/c1-14-7-3-2-6(11)5-4-8(10(12)13)15-9(5)7/h2-4H,1H3,(H,12,13)
InChI Key:
CKFWUXWMXMTOGU-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1sc(c2)C(=O)O)Br
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.93g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.127g/mol
Monoisotopic Mass:
285.93g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.