Home Carboxys tert-butyl 4-(aminomethyl)-3-methylpiperidine-1-carboxylate, Mixture of diastereomers

tert-butyl 4-(aminomethyl)-3-methylpiperidine-1-carboxylate, Mixture of diastereomers

CAS No.:
1236121-41-7
Catalog Number:
AG01BJE8
Molecular Formula:
C12H24N2O2
Molecular Weight:
228.3312
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Product Description
Catalog Number:
AG01BJE8
Chemical Name:
tert-butyl 4-(aminomethyl)-3-methylpiperidine-1-carboxylate, Mixture of diastereomers
CAS Number:
1236121-41-7
Molecular Formula:
C12H24N2O2
Molecular Weight:
228.3312
MDL Number:
MFCD23134560
IUPAC Name:
tert-butyl 4-(aminomethyl)-3-methylpiperidine-1-carboxylate
InChI:
InChI=1S/C12H24N2O2/c1-9-8-14(6-5-10(9)7-13)11(15)16-12(2,3)4/h9-10H,5-8,13H2,1-4H3
InChI Key:
JXSABJPGAQYNHM-UHFFFAOYSA-N
SMILES:
NCC1CCN(CC1C)C(=O)OC(C)(C)C
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.184g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.336g/mol
Monoisotopic Mass:
228.184g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties