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203934-58-1 | 1-Piperidinecarboxylic acid, 4-(1-pyrrolidinylMethylene)-, 1,1-diMethylethyl ester
CAS No: 203934-58-1 Catalog No: AG00297K MDL No:
Product Description
Catalog Number:
AG00297K
Chemical Name:
1-Piperidinecarboxylic acid, 4-(1-pyrrolidinylMethylene)-, 1,1-diMethylethyl ester
CAS Number:
203934-58-1
Molecular Formula:
C15H26N2O2
Molecular Weight:
266.3791
IUPAC Name:
tert-butyl 4-(pyrrolidin-1-ylmethylidene)piperidine-1-carboxylate
InChI:
InChI=1S/C15H26N2O2/c1-15(2,3)19-14(18)17-10-6-13(7-11-17)12-16-8-4-5-9-16/h12H,4-11H2,1-3H3
InChI Key:
WHUQREWHTBAXRE-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(=CN2CCCC2)CC1)OC(C)(C)C
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.199g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.385g/mol
Monoisotopic Mass:
266.199g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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