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1235666-65-5 | (3-(Phenoxymethyl)-1,2,4-oxadiazol-5-yl)methanamine hydrochloride
CAS No: 1235666-65-5 Catalog No: AG01FMET MDL No:MFCD16606055
Product Description
Catalog Number:
AG01FMET
Chemical Name:
(3-(Phenoxymethyl)-1,2,4-oxadiazol-5-yl)methanamine hydrochloride
CAS Number:
1235666-65-5
Molecular Formula:
C10H12ClN3O2
Molecular Weight:
241.6742
MDL Number:
MFCD16606055
IUPAC Name:
[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methanamine;hydrochloride
InChI:
InChI=1S/C10H11N3O2.ClH/c11-6-10-12-9(13-15-10)7-14-8-4-2-1-3-5-8;/h1-5H,6-7,11H2;1H
InChI Key:
IHIBVESPOGTALH-UHFFFAOYSA-N
SMILES:
NCc1onc(n1)COc1ccccc1.Cl
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.062g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.675g/mol
Monoisotopic Mass:
241.062g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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