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850374-97-9

850374-97-9 | 1-Boc-4-(5-Formyl-4-methylthiazol-2-yl);piperidine

CAS No: 850374-97-9 Catalog No: AG004SVE MDL No:MFCD07368515

Product Description

Catalog Number:
AG004SVE
Chemical Name:
1-Boc-4-(5-Formyl-4-methylthiazol-2-yl);piperidine
CAS Number:
850374-97-9
Molecular Formula:
C15H22N2O3S
Molecular Weight:
310.4118
MDL Number:
MFCD07368515
IUPAC Name:
tert-butyl 4-(5-formyl-4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxylate
InChI:
InChI=1S/C15H22N2O3S/c1-10-12(9-18)21-13(16-10)11-5-7-17(8-6-11)14(19)20-15(2,3)4/h9,11H,5-8H2,1-4H3
InChI Key:
WNLBLKQMNXRZLB-UHFFFAOYSA-N
SMILES:
O=Cc1sc(nc1C)C1CCN(CC1)C(=O)OC(C)(C)C

Properties

Complexity:
389  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.135g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.412g/mol
Monoisotopic Mass:
310.135g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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