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6714-68-7

6714-68-7 | Spiro[[1,3]dioxolane-2,3'-indolin]-2'-one

CAS No: 6714-68-7 Catalog No: AG00642C MDL No:MFCD00173689

Product Description

Catalog Number:
AG00642C
Chemical Name:
Spiro[[1,3]dioxolane-2,3'-indolin]-2'-one
CAS Number:
6714-68-7
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD00173689
IUPAC Name:
spiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
InChI:
InChI=1S/C10H9NO3/c12-9-10(13-5-6-14-10)7-3-1-2-4-8(7)11-9/h1-4H,5-6H2,(H,11,12)
InChI Key:
PRMHWSVVQZVDGR-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C31OCCO3)cccc2
NSC Number:
133703

Properties

Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

Literature

Title Journal
Spiro-[1,3-dioxolane-2,3'-indolin]-2'-one. Acta crystallographica. Section E, Structure reports online 20100601
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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