Home Carboxys tert-butyl 4-ethynyl-2-methylpiperidine-1-carboxylate

tert-butyl 4-ethynyl-2-methylpiperidine-1-carboxylate

CAS No.:
2060052-38-0
Catalog Number:
AG01BXDC
Molecular Formula:
C13H21NO2
Molecular Weight:
223.3113
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Product Description
Catalog Number:
AG01BXDC
Chemical Name:
tert-butyl 4-ethynyl-2-methylpiperidine-1-carboxylate
CAS Number:
2060052-38-0
Molecular Formula:
C13H21NO2
Molecular Weight:
223.3113
MDL Number:
MFCD30478046
IUPAC Name:
tert-butyl 4-ethynyl-2-methylpiperidine-1-carboxylate
InChI:
InChI=1S/C13H21NO2/c1-6-11-7-8-14(10(2)9-11)12(15)16-13(3,4)5/h1,10-11H,7-9H2,2-5H3
InChI Key:
CJVRIMIDHYKFLD-UHFFFAOYSA-N
SMILES:
C#CC1CCN(C(C1)C)C(=O)OC(C)(C)C
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.157g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.316g/mol
Monoisotopic Mass:
223.157g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties