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tert-butyl N-(2-bromo-5-fluorophenyl)carbamate

tert-butyl N-(2-bromo-5-fluorophenyl)carbamate

CAS: 861931-75-1

Formula: C11H13BrFNO2

SMILES: CC(C)(C)OC(=O)NC1=C(Br)C=CC(F)=C1

IUPAC: tert-butyl N-(2-bromo-5-fluorophenyl)carbamate

InChI: InChI=1S/C11H13BrFNO2/c1-11(2,3)16-10(15)14-9-6-7(13)4-5-8(9)12/h4-6H,1-3H3,(H,14,15)

Composition: C (45.54%), H (4.52%), Br (27.54%), F (6.55%), N (4.83%), O (11.03%)

Molar Mass: 290.132

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 289.01137
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CYVGIGLTBIHXNS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.19
Topological Polar Surface Area 38.33
Polarizability 24.06
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 861931-75-1 $201.25-$977.50$201.25$621.00$977.50
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