Text Search
Structure Search

N-(4-bromo-2-fluorophenyl)-3,3-dimethylbutanamide

N-(4-bromo-2-fluorophenyl)-3,3-dimethylbutanamide

Formula: C12H15BrFNO

SMILES: CC(C)(C)CC(=O)NC1=CC=C(Br)C=C1F

IUPAC: N-(4-bromo-2-fluorophenyl)-3,3-dimethylbutanamide

InChI: InChI=1S/C12H15BrFNO/c1-12(2,3)7-11(16)15-10-5-4-8(13)6-9(10)14/h4-6H,7H2,1-3H3,(H,15,16)

Composition: C (50.02%), H (5.25%), Br (27.73%), F (6.59%), N (4.86%), O (5.55%)

Molar Mass: 288.16

Atom Count: 31

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 287.032105
Formal Charge 0
FSP3 0.42
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey JDUPRLSFGXRZQV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.01
Topological Polar Surface Area 29.1
Polarizability 25.1
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C12H15BrFNO $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote