Home Halogens ethyl 3-bromo-5-sulfamoylbenzoate

ethyl 3-bromo-5-sulfamoylbenzoate

CAS No.:
1344362-77-1
Catalog Number:
AG01A2GK
Molecular Formula:
C9H10BrNO4S
Molecular Weight:
308.1490
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Product Description
Catalog Number:
AG01A2GK
Chemical Name:
ethyl 3-bromo-5-sulfamoylbenzoate
CAS Number:
1344362-77-1
Molecular Formula:
C9H10BrNO4S
Molecular Weight:
308.1490
MDL Number:
MFCD18205716
IUPAC Name:
ethyl 3-bromo-5-sulfamoylbenzoate
InChI:
InChI=1S/C9H10BrNO4S/c1-2-15-9(12)6-3-7(10)5-8(4-6)16(11,13)14/h3-5H,2H2,1H3,(H2,11,13,14)
InChI Key:
ATIAFQXCJHCQIQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Br)cc(c1)S(=O)(=O)N
Properties
Complexity:
351  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.951g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
308.146g/mol
Monoisotopic Mass:
306.951g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties