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N-[2-bromo-5-(hydroxymethyl)pyridin-3-yl]-2,2-dimethylpropanamide

N-[2-bromo-5-(hydroxymethyl)pyridin-3-yl]-2,2-dimethylpropanamide

CAS: 1171919-92-8

Formula: C11H15BrN2O2

SMILES: CC(C)(C)C(=O)NC1=CC(CO)=CN=C1Br

IUPAC: N-[2-bromo-5-(hydroxymethyl)pyridin-3-yl]-2,2-dimethylpropanamide

InChI: InChI=1S/C11H15BrN2O2/c1-11(2,3)10(16)14-8-4-7(6-15)5-13-9(8)12/h4-5,15H,6H2,1-3H3,(H,14,16)

Composition: C (46.01%), H (5.27%), Br (27.83%), N (9.76%), O (11.14%)

Molar Mass: 287.157

Atom Count: 31

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 286.031691
Formal Charge 0
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey JTCXLOHRNWOXLT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.75
Topological Polar Surface Area 62.22
Polarizability 25.22
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1171919-92-8 $1,000.00-$2,370.00$1,000.00$1,754.00$2,370.00
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