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312736-49-5

312736-49-5 | 3,5-dichloropyrazine-2-carboxylic acid

CAS No: 312736-49-5 Catalog No: AG0038TD MDL No:MFCD09909819

Product Description

Catalog Number:
AG0038TD
Chemical Name:
3,5-dichloropyrazine-2-carboxylic acid
CAS Number:
312736-49-5
Molecular Formula:
C5H2Cl2N2O2
Molecular Weight:
192.9876
MDL Number:
MFCD09909819
IUPAC Name:
3,5-dichloropyrazine-2-carboxylic acid
InChI:
InChI=1S/C5H2Cl2N2O2/c6-2-1-8-3(5(10)11)4(7)9-2/h1H,(H,10,11)
InChI Key:
QRFOSHOPPFYNAH-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncc(nc1Cl)Cl

Properties

Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.949g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.983g/mol
Monoisotopic Mass:
191.949g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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