CAS
914927-57-4 Purity
96%
914927-57-4 Purity
96%
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4-Nitro-4-biphenylsulfonic acid
CAS
91493-72-0
Catalog Number
ACM91493720
Category
Other Products
Molecular Weight
279.268560 [g/mol]
Molecular Formula
C12H9NO5S
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Specification
Synonyms
4-NITRO-4-BIPHENYLSULFONIC ACID, 91493-72-0, CTK5G9712, AKOS015966320, AG-H-75540, KB-193605
IUPAC Name
4-(4-nitrophenyl)benzenesulfonic acid
InChI Key
YTLRCQWMAYGBFQ-UHFFFAOYSA-N
Density
1.474g/cm³
Exact Mass
279.02000
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of 4-Nitro-4-biphenylsulfonic acid?
The molecular formula is C12H9NO5S.
What is the PubChem CID of 4-Nitro-4-biphenylsulfonic acid?
The PubChem CID is 53425882.
What is the molecular weight of 4-Nitro-4-biphenylsulfonic acid?
The molecular weight is 279.27 g/mol.
What is the IUPAC name of 4-Nitro-4-biphenylsulfonic acid?
The IUPAC name is 4-(4-nitrophenyl)benzenesulfonic acid.
What is the InChI of 4-Nitro-4-biphenylsulfonic acid?
The InChI is InChI=1S/C12H9NO5S/c14-13(15)11-5-1-9(2-6-11)10-3-7-12(8-4-10)19(16,17)18/h1-8H,(H,16,17,18).
What is the InChIKey of 4-Nitro-4-biphenylsulfonic acid?
The InChIKey is YTLRCQWMAYGBFQ-UHFFFAOYSA-N.
What is the canonical SMILES of 4-Nitro-4-biphenylsulfonic acid?
The canonical SMILES is C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)O)[N+](=O)[O-].
What is the CAS number of 4-Nitro-4-biphenylsulfonic acid?
The CAS number is 91493-72-0.
What is the XLogP3-AA value of 4-Nitro-4-biphenylsulfonic acid?
The XLogP3-AA value is 2.1.
Is 4-Nitro-4-biphenylsulfonic acid a canonicalized compound in PubChem?
Yes, it is a canonicalized compound in PubChem.
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