CAS
92384-46-8 Purity
96%
92384-46-8 Purity
96%
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9H-Thioxanthene,2-chloro-
CAS
92-38-6
Catalog Number
ACM92386
Category
Other Products
Molecular Weight
232.7286
Molecular Formula
C13H9ClS
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Specification
Synonyms
2-Chlorothioxanthene, 2-Chloro-9H-thioxanthene, 92-38-6, NSC54679, 2-Chlorothiaxanthene, AC1L6CZO, Thioxanthene, 2-chloro-, SureCN130334, 9H-Thioxanthene, 2-chloro-, CHEMBL309280, CTK5H1224, NSC-54679, AG-J-46226
IUPAC Name
2-chloro-9H-thioxanthene
Canonical SMILES
C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl
InChI Key
HRJYGQAACVZSEO-UHFFFAOYSA-N
Boiling Point
360.1ºC at 760mmHg
Flash Point
161.1ºC
Density
1.311g/cm³
Exact Mass
232.01100
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of 2-Chlorothioxanthene?
The molecular formula of 2-Chlorothioxanthene is C13H9ClS.
What is the molecular weight of 2-Chlorothioxanthene?
The molecular weight of 2-Chlorothioxanthene is 232.73 g/mol.
When was 2-Chlorothioxanthene created in PubChem?
2-Chlorothioxanthene was created in PubChem on March 26, 2005.
What is the InChI of 2-Chlorothioxanthene?
The InChI of 2-Chlorothioxanthene is InChI=1S/C13H9ClS/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)15-13/h1-6,8H,7H2.
What is the InChIKey of 2-Chlorothioxanthene?
The InChIKey of 2-Chlorothioxanthene is HRJYGQAACVZSEO-UHFFFAOYSA-N.
What is the Canonical SMILES of 2-Chlorothioxanthene?
The Canonical SMILES of 2-Chlorothioxanthene is C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.
What is the XLogP3 value of 2-Chlorothioxanthene?
The XLogP3 value of 2-Chlorothioxanthene is 4.5.
How many hydrogen bond acceptor counts does 2-Chlorothioxanthene have?
2-Chlorothioxanthene has 1 hydrogen bond acceptor count.
What is the heavy atom count of 2-Chlorothioxanthene?
The heavy atom count of 2-Chlorothioxanthene is 15.
Is the compound canonicalized in PubChem?
Yes, the compound is canonicalized in PubChem.
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