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Home > Bromides > 1277175-87-7
1277175-87-7 | Benzamide, N-(3-bromo-2-benzofuranyl)-4-methoxy-
CAS No: 1277175-87-7 Catalog No: AG000XC1 MDL No:
Product Description
Catalog Number:
AG000XC1
Chemical Name:
Benzamide, N-(3-bromo-2-benzofuranyl)-4-methoxy-
CAS Number:
1277175-87-7
Molecular Formula:
C16H12BrNO3
Molecular Weight:
346.1754
IUPAC Name:
N-(3-bromo-1-benzofuran-2-yl)-4-methoxybenzamide
InChI:
InChI=1S/C16H12BrNO3/c1-20-11-8-6-10(7-9-11)15(19)18-16-14(17)12-4-2-3-5-13(12)21-16/h2-9H,1H3,(H,18,19)
InChI Key:
DJSSRPRBAANGHG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)Nc1oc2c(c1Br)cccc2
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
346.18g/mol
Monoisotopic Mass:
345g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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