Home Carboxys ethyl 5-[3-(aminomethyl)phenyl]-1,2,4-oxadiazole-3-carboxylate hydrochloride

ethyl 5-[3-(aminomethyl)phenyl]-1,2,4-oxadiazole-3-carboxylate hydrochloride

CAS No.:
1798702-20-1
Catalog Number:
AG01BD4R
Molecular Formula:
C12H14ClN3O3
Molecular Weight:
283.7109
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BD4R
Chemical Name:
ethyl 5-[3-(aminomethyl)phenyl]-1,2,4-oxadiazole-3-carboxylate hydrochloride
CAS Number:
1798702-20-1
Molecular Formula:
C12H14ClN3O3
Molecular Weight:
283.7109
MDL Number:
MFCD28064218
IUPAC Name:
ethyl 5-[3-(aminomethyl)phenyl]-1,2,4-oxadiazole-3-carboxylate;hydrochloride
InChI:
InChI=1S/C12H13N3O3.ClH/c1-2-17-12(16)10-14-11(18-15-10)9-5-3-4-8(6-9)7-13;/h3-6H,2,7,13H2,1H3;1H
InChI Key:
KVDICHWATVGGSN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1noc(n1)c1cccc(c1)CN.Cl
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.072g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
283.712g/mol
Monoisotopic Mass:
283.072g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties