Text Search
Structure Search

2-bromo-4-cyanobenzamide

2-bromo-4-cyanobenzamide

Formula: C8H5BrN2O

SMILES: NC(=O)C1=C(Br)C=C(C=C1)C#N

IUPAC: 2-bromo-4-cyanobenzamide

InChI: InChI=1S/C8H5BrN2O/c9-7-3-5(4-10)1-2-6(7)8(11)12/h1-3H,(H2,11,12)

Composition: C (42.70%), H (2.24%), Br (35.51%), N (12.45%), O (7.11%)

Molar Mass: 225.045

Atom Count: 17

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 223.958526
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey VOTKOXRXLFPVSM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.48
Topological Polar Surface Area 66.88
Polarizability 17.92
Ring Count 1
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Struchem co.,ltd
Supplier Profile
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C8H5BrN2O $1,460.00-$3,190.00$1,460.00$1,700.00$3,190.00
Request Quote