Home Carboxys tert-butyl 4-cyano-4-pyrrolidin-1-ylpiperidine-1-carboxylate(SALTDATA

tert-butyl 4-cyano-4-pyrrolidin-1-ylpiperidine-1-carboxylate(SALTDATA

CAS No.:
1119452-74-2
Catalog Number:
AG008VEY
Molecular Formula:
C15H25N3O2
Molecular Weight:
279.3779
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Product Description
Catalog Number:
AG008VEY
Chemical Name:
tert-butyl 4-cyano-4-pyrrolidin-1-ylpiperidine-1-carboxylate(SALTDATA
CAS Number:
1119452-74-2
Molecular Formula:
C15H25N3O2
Molecular Weight:
279.3779
IUPAC Name:
tert-butyl 4-cyano-4-pyrrolidin-1-ylpiperidine-1-carboxylate
InChI:
InChI=1S/C15H25N3O2/c1-14(2,3)20-13(19)17-10-6-15(12-16,7-11-17)18-8-4-5-9-18/h4-11H2,1-3H3
InChI Key:
FWRYMXJQVHVJHC-UHFFFAOYSA-N
SMILES:
N#CC1(CCN(CC1)C(=O)OC(C)(C)C)N1CCCC1
Properties
Complexity:
405  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.195g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.384g/mol
Monoisotopic Mass:
279.195g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties