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54716-02-8

54716-02-8 | (E)-Ethyl 3-(pyrrolidin-1-yl)but-2-enoate

CAS No: 54716-02-8 Catalog No: AG0038NM MDL No:MFCD00014097

Product Description

Catalog Number:
AG0038NM
Chemical Name:
(E)-Ethyl 3-(pyrrolidin-1-yl)but-2-enoate
CAS Number:
54716-02-8
Molecular Formula:
C10H17NO2
Molecular Weight:
183.2475
MDL Number:
MFCD00014097
IUPAC Name:
ethyl (E)-3-pyrrolidin-1-ylbut-2-enoate
InChI:
InChI=1S/C10H17NO2/c1-3-13-10(12)8-9(2)11-6-4-5-7-11/h8H,3-7H2,1-2H3/b9-8+
InChI Key:
MSOQKPXSIHLODG-CMDGGOBGSA-N
SMILES:
CCOC(=O)/C=C(/N1CCCC1)\C
EC Number:
259-303-3

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
183.126g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.251g/mol
Monoisotopic Mass:
183.126g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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