CAS
97552-53-9 Purity
96%
97552-53-9 Purity
96%
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Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride
CAS
97552-60-8
Catalog Number
ACM97552608
Category
Other Products
Molecular Weight
268.6763
Molecular Formula
C10H5ClN2O3S
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Specification
Synonyms
EINECS 307-113-7, Naphth(2,1-d)(1,2,3)oxadiazole-6-sulphonyl chloride, 97552-60-8
IUPAC Name
benzo[g][1,2,3]benzoxadiazole-6-sulfonyl chloride
Canonical SMILES
C1=CC2=C(C=CC3=C2ON=N3)C(=C1)S(=O)(=O)Cl
InChI Key
PEANXEYQMOELEQ-UHFFFAOYSA-N
Boiling Point
425.5ºC at 760mmHg
Flash Point
211.1ºC
Density
1.642g/cm³
EC Number
307-113-7
Exact Mass
267.97100
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride?
The molecular formula is C10H5ClN2O3S.
When was Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride created in PubChem?
It was created on August 20, 2009.
What is the IUPAC name of Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride?
The IUPAC name is benzo[g][1,2,3]benzoxadiazole-6-sulfonyl chloride.
How is the InChI of Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride computed?
The InChI is computed by InChI 1.0.6.
What is the Canonical SMILES of Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride?
The Canonical SMILES is C1=CC2=C(C=CC3=C2ON=N3)C(=C1)S(=O)(=O)Cl.
What is the CAS number of Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride?
The CAS number is 97552-60-8.
What is the molecular weight of Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride?
The molecular weight is 268.68 g/mol.
How many hydrogen bond acceptor counts does Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride have?
It has 5 hydrogen bond acceptor counts.
What is the topological polar surface area of Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride?
The topological polar surface area is 81.4 Å2.
Is the compound Naphth[2,1-d][1,2,3]oxadiazole-6-sulfonyl chloride canonicalized?
Yes, the compound is canonicalized according to PubChem.
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