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850429-70-8

850429-70-8 | N-t-Butyl 3-bromo-4-methylbenzenesulfonamide

CAS No: 850429-70-8 Catalog No: AG003TCQ MDL No:MFCD07363835

Product Description

Catalog Number:
AG003TCQ
Chemical Name:
N-t-Butyl 3-bromo-4-methylbenzenesulfonamide
CAS Number:
850429-70-8
Molecular Formula:
C11H16BrNO2S
Molecular Weight:
306.2192
MDL Number:
MFCD07363835
IUPAC Name:
3-bromo-N-tert-butyl-4-methylbenzenesulfonamide
InChI:
InChI=1S/C11H16BrNO2S/c1-8-5-6-9(7-10(8)12)16(14,15)13-11(2,3)4/h5-7,13H,1-4H3
InChI Key:
GZGHIWXQPZQUHK-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1Br)S(=O)(=O)NC(C)(C)C

Properties

Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.009g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
306.218g/mol
Monoisotopic Mass:
305.009g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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