Home Halogens 2-(5-chloro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(prop-2-yn-1-yl)acetamide

2-(5-chloro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(prop-2-yn-1-yl)acetamide

CAS No.:
1020956-98-2
Catalog Number:
AG01A8PD
Molecular Formula:
C13H9ClN2O3
Molecular Weight:
276.6752
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Product Description
Catalog Number:
AG01A8PD
Chemical Name:
2-(5-chloro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(prop-2-yn-1-yl)acetamide
CAS Number:
1020956-98-2
Molecular Formula:
C13H9ClN2O3
Molecular Weight:
276.6752
MDL Number:
MFCD12448422
IUPAC Name:
2-(5-chloro-2,3-dioxoindol-1-yl)-N-prop-2-ynylacetamide
InChI:
InChI=1S/C13H9ClN2O3/c1-2-5-15-11(17)7-16-10-4-3-8(14)6-9(10)12(18)13(16)19/h1,3-4,6H,5,7H2,(H,15,17)
InChI Key:
LDBJZDVCSHAGIY-UHFFFAOYSA-N
SMILES:
C#CCNC(=O)CN1c2ccc(cc2C(=O)C1=O)Cl
Properties
Complexity:
468  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.03g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
276.676g/mol
Monoisotopic Mass:
276.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties