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883548-05-8 | 1-[3-(2-CHLOROPHENYL)-1,2,4-OXADIAZOL-5-YL]METHANAMINE
CAS No: 883548-05-8 Catalog No: AG0045RX MDL No:MFCD07186490
Product Description
Catalog Number:
AG0045RX
Chemical Name:
1-[3-(2-CHLOROPHENYL)-1,2,4-OXADIAZOL-5-YL]METHANAMINE
CAS Number:
883548-05-8
Molecular Formula:
C9H8ClN3O
Molecular Weight:
209.6323
MDL Number:
MFCD07186490
IUPAC Name:
[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methanamine
InChI:
InChI=1S/C9H8ClN3O/c10-7-4-2-1-3-6(7)9-12-8(5-11)14-13-9/h1-4H,5,11H2
InChI Key:
AMZQOYAZUMRSPX-UHFFFAOYSA-N
SMILES:
NCc1onc(n1)c1ccccc1Cl
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.633g/mol
Monoisotopic Mass:
209.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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