Home Other Building Blocks 3-Aminomethyl-6,7-Dihydro-4H-Isoxazolo[4,5-C]Pyridine-5-Carboxylic Acid Tert-Butyl Ester

3-Aminomethyl-6,7-Dihydro-4H-Isoxazolo[4,5-C]Pyridine-5-Carboxylic Acid Tert-Butyl Ester

CAS No.:
1250997-56-8
Catalog Number:
AG00HHXS
Molecular Formula:
C12H19N3O3
Molecular Weight:
253.2976
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Product Description
Catalog Number:
AG00HHXS
Chemical Name:
3-Aminomethyl-6,7-Dihydro-4H-Isoxazolo[4,5-C]Pyridine-5-Carboxylic Acid Tert-Butyl Ester
CAS Number:
1250997-56-8
Molecular Formula:
C12H19N3O3
Molecular Weight:
253.2976
MDL Number:
MFCD17017151
IUPAC Name:
tert-butyl 3-(aminomethyl)-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-5-carboxylate
InChI:
InChI=1S/C12H19N3O3/c1-12(2,3)17-11(16)15-5-4-10-8(7-15)9(6-13)14-18-10/h4-7,13H2,1-3H3
InChI Key:
SKYCJNRFGSTZFH-UHFFFAOYSA-N
SMILES:
NCc1noc2c1CN(CC2)C(=O)OC(C)(C)C
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.143g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.302g/mol
Monoisotopic Mass:
253.143g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties