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119715-32-1 | 2(1H)-Quinolinone, 6-(2-chloroacetyl)-3,4-dihydro-7-hydroxy-
CAS No: 119715-32-1 Catalog No: AG000PI9 MDL No:
Product Description
Catalog Number:
AG000PI9
Chemical Name:
2(1H)-Quinolinone, 6-(2-chloroacetyl)-3,4-dihydro-7-hydroxy-
CAS Number:
119715-32-1
Molecular Formula:
C11H10ClNO3
Molecular Weight:
239.6550
IUPAC Name:
6-(2-chloroacetyl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
InChI:
InChI=1S/C11H10ClNO3/c12-5-10(15)7-3-6-1-2-11(16)13-8(6)4-9(7)14/h3-4,14H,1-2,5H2,(H,13,16)
InChI Key:
VYMHRWBDIKJEGD-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1cc2CCC(=O)Nc2cc1O
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.035g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.655g/mol
Monoisotopic Mass:
239.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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