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2-bromo-N-methylbutanamide hydrochloride

2-bromo-N-methylbutanamide hydrochloride

CAS: 42275-49-0

Formula: C5H11BrClNO

SMILES: Cl.CCC(Br)C(=O)NC

IUPAC: 2-bromo-N-methylbutanamide hydrochloride

InChI: InChI=1/C5H10BrNO.ClH/c1-3-4(6)5(8)7-2;/h4H,3H2,1-2H3,(H,7,8);1H

Composition: C (27.74%), H (5.12%), Br (36.91%), Cl (16.37%), N (6.47%), O (7.39%)

Molar Mass: 216.5

Atom Count: 20

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 214.971255
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey WJYLYECPFNOIIU-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.12
Topological Polar Surface Area 29.1
Polarizability 14.02
Ring Count 0
Rotatable Bond Count 2

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95% <2 Days 42275-49-0 $225.06-$1,078.30$225.06$225.06$359.43$359.43$1,078.30$1,078.30
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