Home Carboxys tert-Butyl 5-(aminomethyl)isoindoline-2-carboxylate

tert-Butyl 5-(aminomethyl)isoindoline-2-carboxylate

CAS No.:
885271-40-9
Catalog Number:
AG003ATG
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
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Product Description
Catalog Number:
AG003ATG
Chemical Name:
tert-Butyl 5-(aminomethyl)isoindoline-2-carboxylate
CAS Number:
885271-40-9
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
MDL Number:
MFCD00053926
IUPAC Name:
tert-butyl 5-(aminomethyl)-1,3-dihydroisoindole-2-carboxylate
InChI:
InChI=1S/C14H20N2O2/c1-14(2,3)18-13(17)16-8-11-5-4-10(7-15)6-12(11)9-16/h4-6H,7-9,15H2,1-3H3
InChI Key:
OGYVTVAVBOUPSP-UHFFFAOYSA-N
SMILES:
NCc1ccc2c(c1)CN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.152g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.326g/mol
Monoisotopic Mass:
248.152g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties