Home Carboxys ethyl 4-(prop-2-yn-1-yl)piperidine-4-carboxylate

ethyl 4-(prop-2-yn-1-yl)piperidine-4-carboxylate

CAS No.:
21837-08-1
Catalog Number:
AG01EMT9
Molecular Formula:
C11H17NO2
Molecular Weight:
195.2582
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Product Description
Catalog Number:
AG01EMT9
Chemical Name:
ethyl 4-(prop-2-yn-1-yl)piperidine-4-carboxylate
CAS Number:
21837-08-1
Molecular Formula:
C11H17NO2
Molecular Weight:
195.2582
MDL Number:
MFCD31645245
IUPAC Name:
ethyl 4-prop-2-ynylpiperidine-4-carboxylate
InChI:
InChI=1S/C11H17NO2/c1-3-5-11(10(13)14-4-2)6-8-12-9-7-11/h1,12H,4-9H2,2H3
InChI Key:
GHXIBYUAHRXRCM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CCNCC1)CC#C
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.126g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.262g/mol
Monoisotopic Mass:
195.126g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties