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74037-78-8

74037-78-8 | 1-(4-hydroxyquinolin-3-yl)ethanone

CAS No: 74037-78-8 Catalog No: AG005I7E MDL No:MFCD13704610

Product Description

Catalog Number:
AG005I7E
Chemical Name:
1-(4-hydroxyquinolin-3-yl)ethanone
CAS Number:
74037-78-8
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
MDL Number:
MFCD13704610
IUPAC Name:
3,5,5-trimethyl-1-morpholin-4-ylhexane-1-thione
InChI:
InChI=1S/C13H25NOS/c1-11(10-13(2,3)4)9-12(16)14-5-7-15-8-6-14/h11H,5-10H2,1-4H3
InChI Key:
PHTIKHPLGOWBCS-UHFFFAOYSA-N
SMILES:
CC(=O)c1cnc2c(c1O)cccc2
NSC Number:
83169

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.166g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.409g/mol
Monoisotopic Mass:
243.166g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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