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Ibrotamida,Ibrotamide,Ibrotamidum,Ibrotalum,Ibrotamide [INN:DCF],2-Bro

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摘 要:Ibrotamida,Ibrotamide,Ibrotamidum,Ibrotalum,Ibrotamide [INN:DCF],2-Brom-2-ethylisovaleramid,alpha-Ethyl-alpha-brom-isovaleramid,2-Bromo-N-ethyl-N-isopropylacetamide,466-14-8, 2-bromo-2-ethyl-3-methylbutanamide,Canonical SMILES: CCC(C(C)C)(C(=O)N)Br,I
[Synonyms]
Ibrotamida
Ibrotamide
Ibrotamidum
Ibrotalum
Ibrotamide [INN:DCF]
2-Brom-2-ethylisovaleramid
alpha-Ethyl-alpha-brom-isovaleramid
2-Bromo-N-ethyl-N-isopropylacetamide
466-14-8

[Structure]
Ibrotamida,Ibrotamide,Ibrotamidum,Ibrotalum,Ibrotamide [INN:DCF],2-Bro

[ Properties Computed from Structure]
Molecular Weight208.09616 [g/mol]
Molecular FormulaC7H14BrNO
XLogP1.3
H-Bond Donor1
H-Bond Acceptor1
Rotatable Bond Count3
Tautomer Count2
Exact Mass207.025877
MonoIsotopic Mass207.025877
Topological Polar Surface Area43.1
Heavy Atom Count10
Formal Charge0
Complexity136
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count1
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 2-bromo-2-ethyl-3-methylbutanamide
Canonical SMILES: CCC(C(C)C)(C(=O)N)Br
InChI: InChI=1/C7H14BrNO/c1-4-7(8,5(2)3)6(9)10/h5H,4H2,1-3H3,(H2,9,10)/f/h9H2

 
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