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2138-98-9

2138-98-9 | 5-(2-Chlorophenyl);-1,3,4-oxadiazol-2-amine

CAS No: 2138-98-9 Catalog No: AG003GG2 MDL No:MFCD00469199

Product Description

Catalog Number:
AG003GG2
Chemical Name:
5-(2-Chlorophenyl);-1,3,4-oxadiazol-2-amine
CAS Number:
2138-98-9
Molecular Formula:
C8H6ClN3O
Molecular Weight:
195.6057
MDL Number:
MFCD00469199
IUPAC Name:
5-(2-chlorophenyl)-1,3,4-oxadiazol-2-amine
InChI:
InChI=1S/C8H6ClN3O/c9-6-4-2-1-3-5(6)7-11-12-8(10)13-7/h1-4H,(H2,10,12)
InChI Key:
VVKFAXPORKOLTL-UHFFFAOYSA-N
SMILES:
Nc1nnc(o1)c1ccccc1Cl

Properties

Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.02g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.606g/mol
Monoisotopic Mass:
195.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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