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1008946-66-4

1008946-66-4 | 2-Piperidinecarboxylic acid, 1-(2-chloroacetyl)-, ethyl ester

CAS No: 1008946-66-4 Catalog No: AG00033Q MDL No:MFCD01480671

Product Description

Catalog Number:
AG00033Q
Chemical Name:
2-Piperidinecarboxylic acid, 1-(2-chloroacetyl)-, ethyl ester
CAS Number:
1008946-66-4
Molecular Formula:
C10H16ClNO3
Molecular Weight:
233.6919
MDL Number:
MFCD01480671
IUPAC Name:
ethyl 1-(2-chloroacetyl)piperidine-2-carboxylate
InChI:
InChI=1S/C10H16ClNO3/c1-2-15-10(14)8-5-3-4-6-12(8)9(13)7-11/h8H,2-7H2,1H3
InChI Key:
LVJSWQWZFDHDMV-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCCCN1C(=O)CCl

Properties

Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.082g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.692g/mol
Monoisotopic Mass:
233.082g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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