Text Search
Structure Search

3,5-diamino-6-bromopyrazine-2-carboxylic acid

3,5-diamino-6-bromopyrazine-2-carboxylic acid

CAS: 1303968-25-3

Formula: C5H5BrN4O2

SMILES: NC1=NC(N)=C(N=C1Br)C(O)=O

IUPAC: 3,5-diamino-6-bromopyrazine-2-carboxylic acid

InChI: InChI=1S/C5H5BrN4O2/c6-2-4(8)10-3(7)1(9-2)5(11)12/h(H,11,12)(H4,7,8,10)

Composition: C (25.77%), H (2.16%), Br (34.29%), N (24.04%), O (13.73%)

Molar Mass: 233.025

Atom Count: 17

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 231.959588
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 3
InChIKey FDPDGMKZZNURGR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.12
Topological Polar Surface Area 115.12
Polarizability 16.49
Ring Count 1
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
J&W PHARMLAB LLC
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 1303968-25-3 $171.35-$2,748.50$171.35$227.70$342.70$457.70$687.70$2,748.50
Request Quote