Home Carboxys tert-butyl 4-formyl-3-methylpiperidine-1-carboxylate

tert-butyl 4-formyl-3-methylpiperidine-1-carboxylate

CAS No.:
512822-18-3
Catalog Number:
AG01BBHF
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
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Product Description
Catalog Number:
AG01BBHF
Chemical Name:
tert-butyl 4-formyl-3-methylpiperidine-1-carboxylate
CAS Number:
512822-18-3
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
IUPAC Name:
tert-butyl 4-formyl-3-methylpiperidine-1-carboxylate
InChI:
InChI=1S/C12H21NO3/c1-9-7-13(6-5-10(9)8-14)11(15)16-12(2,3)4/h8-10H,5-7H2,1-4H3
InChI Key:
PLVBIBPBUCVLHC-UHFFFAOYSA-N
SMILES:
O=CC1CCN(CC1C)C(=O)OC(C)(C)C
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.152g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.304g/mol
Monoisotopic Mass:
227.152g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties