Home Halogens tert-butyl 4-(2-bromoethenyl)piperidine-1-carboxylate

tert-butyl 4-(2-bromoethenyl)piperidine-1-carboxylate

CAS No.:
2138824-00-5
Catalog Number:
AG01EM1B
Molecular Formula:
C12H20BrNO2
Molecular Weight:
290.1967
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Product Description
Catalog Number:
AG01EM1B
Chemical Name:
tert-butyl 4-(2-bromoethenyl)piperidine-1-carboxylate
CAS Number:
2138824-00-5
Molecular Formula:
C12H20BrNO2
Molecular Weight:
290.1967
MDL Number:
MFCD31664976
IUPAC Name:
tert-butyl 4-[(E)-2-bromoethenyl]piperidine-1-carboxylate
InChI:
InChI=1S/C12H20BrNO2/c1-12(2,3)16-11(15)14-8-5-10(4-7-13)6-9-14/h4,7,10H,5-6,8-9H2,1-3H3/b7-4+
InChI Key:
SJDSFQOGWBCCFH-QPJJXVBHSA-N
SMILES:
BrC=CC1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
289.068g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.201g/mol
Monoisotopic Mass:
289.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties