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90902-89-9

90902-89-9 | 1H-Isoindole-1,3(2H)-dione, 2-(acetyltrithio)-

CAS No: 90902-89-9 Catalog No: AG006GOS MDL No:

Product Description

Catalog Number:
AG006GOS
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(acetyltrithio)-
CAS Number:
90902-89-9
Molecular Formula:
C10H7NO3S3
Molecular Weight:
285.3625
IUPAC Name:
S-[(1,3-dioxoisoindol-2-yl)disulfanyl] ethanethioate
InChI:
InChI=1S/C10H7NO3S3/c1-6(12)15-17-16-11-9(13)7-4-2-3-5-8(7)10(11)14/h2-5H,1H3
InChI Key:
OJRKDWZAPOVRCM-UHFFFAOYSA-N
SMILES:
CC(=O)SSSN1C(=O)c2c(C1=O)cccc2

Properties

Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.959g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.35g/mol
Monoisotopic Mass:
284.959g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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