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89187-65-5 | Ethanesulfinamide, 2-bromo-N-butyl-
CAS No: 89187-65-5 Catalog No: AG003VNF MDL No:
Product Description
Catalog Number:
AG003VNF
Chemical Name:
Ethanesulfinamide, 2-bromo-N-butyl-
CAS Number:
89187-65-5
Molecular Formula:
C6H14BrNOS
Molecular Weight:
228.1505
IUPAC Name:
2-bromo-N-butylethanesulfinamide
InChI:
InChI=1S/C6H14BrNOS/c1-2-3-5-8-10(9)6-4-7/h8H,2-6H2,1H3
InChI Key:
AHQZRIBCEPPOPV-UHFFFAOYSA-N
SMILES:
CCCCNS(=O)CCBr
Properties
Complexity:
99.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.998g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.148g/mol
Monoisotopic Mass:
226.998g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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