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19805-73-3

19805-73-3 | 2-Cyclohexen-1-one, 3-(1-pyrrolidinyl)-

CAS No: 19805-73-3 Catalog No: AG002B8Y MDL No:

Product Description

Catalog Number:
AG002B8Y
Chemical Name:
2-Cyclohexen-1-one, 3-(1-pyrrolidinyl)-
CAS Number:
19805-73-3
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
IUPAC Name:
3-pyrrolidin-1-ylcyclohex-2-en-1-one
InChI:
InChI=1S/C10H15NO/c12-10-5-3-4-9(8-10)11-6-1-2-7-11/h8H,1-7H2
InChI Key:
XODAXSHZSFXIST-UHFFFAOYSA-N
SMILES:
O=C1CCCC(=C1)N1CCCC1
NSC Number:
118768

Properties

Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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