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98303-20-9 | 1-(tert-Butoxycarbonyl)piperidine-2-carboxylic acid
CAS No: 98303-20-9 Catalog No: AG003SU5 MDL No:MFCD01862877
Product Description
Catalog Number:
AG003SU5
Chemical Name:
1-(tert-Butoxycarbonyl)piperidine-2-carboxylic acid
CAS Number:
98303-20-9
Molecular Formula:
C11H19NO4
Molecular Weight:
229.2729
MDL Number:
MFCD01862877
IUPAC Name:
1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
InChI:
InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
InChI Key:
JQAOHGMPAAWWQO-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCCN1C(=O)OC(C)(C)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.276g/mol
Monoisotopic Mass:
229.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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