CAS
93981-69-2 Purity
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93981-69-2 Purity
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5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one
CAS
93981-76-1
Catalog Number
ACM93981761
Category
Other Products
Molecular Weight
365.597980 [g/mol]
Molecular Formula
C16H7Cl3N2O2
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Specification
Synonyms
EINECS 301-163-3, CID6366340, 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one, 93981-76-1
IUPAC Name
(2E)-5,7-dichloro-2-(5-chloro-3-oxo-1H-indol-2-ylidene)-1H-indol-3-one
Canonical SMILES
C1=CC2=C(C=C1Cl)C(=O)C(=C3C(=O)C4=CC(=CC(=C4N3)Cl)Cl)N2
InChI Key
AGLUIPTUDICXMS-BUHFOSPRSA-N
Boiling Point
496.9ºC at 760mmHg
Flash Point
254.3ºC
Density
1.655g/cm³
EC Number
301-163-3
Exact Mass
363.95700
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
The molecular formula is C16H7Cl3N2O2.
What is the synonym for 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
A synonym is 5,5',7-Trichloro-[2,2'-biindolinylidene]-3,3'-dione.
What is the molecular weight of 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
The molecular weight is 365.6 g/mol.
What is the canonical SMILES for 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
The canonical SMILES is C1=CC2=C(C=C1Cl)C(=O)C(=N2)C3=C(C4=C(N3)C(=CC(=C4)Cl)Cl)O.
What is the hydrogen bond donor count of 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
The hydrogen bond donor count is 2.
What is the topological polar surface area of 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
The topological polar surface area is 65.4 Ų.
What is the exact mass and monoisotopic mass of 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
The exact mass and monoisotopic mass are both 363.957311 g/mol.
How many heavy atoms are present in the compound 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
There are 23 heavy atoms.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the InChIKey of 5,7-Dichloro-2-(5-chloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one?
The InChIKey is XXUSIPXPSUCRMA-UHFFFAOYSA-N.
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