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280115-99-3 | tert-Butyl 4-(Chlorocarbonyl)piperidine-1-carboxylate
CAS No: 280115-99-3 Catalog No: AG01F8BZ MDL No:
Product Description
Catalog Number:
AG01F8BZ
Chemical Name:
tert-Butyl 4-(Chlorocarbonyl)piperidine-1-carboxylate
CAS Number:
280115-99-3
Molecular Formula:
C11H18ClNO3
Molecular Weight:
247.7185
IUPAC Name:
tert-butyl 4-carbonochloridoylpiperidine-1-carboxylate
InChI:
InChI=1S/C11H18ClNO3/c1-11(2,3)16-10(15)13-6-4-8(5-7-13)9(12)14/h8H,4-7H2,1-3H3
InChI Key:
LUKQTNVNMALRMG-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)C(=O)Cl)OC(C)(C)C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.098g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.719g/mol
Monoisotopic Mass:
247.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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