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127656-32-0 | 1,3(2H,5H)-Indolizinedione, 2-(2,4-dichlorophenyl)tetrahydro-
CAS No: 127656-32-0 Catalog No: AG000X9R MDL No:
Product Description
Catalog Number:
AG000X9R
Chemical Name:
1,3(2H,5H)-Indolizinedione, 2-(2,4-dichlorophenyl)tetrahydro-
CAS Number:
127656-32-0
Molecular Formula:
C14H13Cl2NO2
Molecular Weight:
298.1645
IUPAC Name:
2-(2,4-dichlorophenyl)-6,7,8,8a-tetrahydro-5H-indolizine-1,3-dione
InChI:
InChI=1S/C14H13Cl2NO2/c15-8-4-5-9(10(16)7-8)12-13(18)11-3-1-2-6-17(11)14(12)19/h4-5,7,11-12H,1-3,6H2
InChI Key:
FOTIDSCMHUVLGK-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)C1C(=O)C2N(C1=O)CCCC2
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.032g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.163g/mol
Monoisotopic Mass:
297.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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