CAS
94275-86-2 Purity
96%
94275-86-2 Purity
96%
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Calcium hydrogen 3,4,5,6-tetrachlorophthalate
CAS
94275-90-8
Catalog Number
ACM94275908
Category
Other Products
Molecular Weight
645.884280 [g/mol]
Molecular Formula
C16H2CaCl8O8
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Specification
Synonyms
Calcium hydrogen 3,4,5,6-tetrachlorophthalate, 94275-90-8, CTK5H6179, EINECS 304-478-4, AG-H-89067
IUPAC Name
calcium;2-carboxy-3,4,5,6-tetrachlorobenzoate
InChI Key
UORLIJOZQJVHRZ-UHFFFAOYSA-L
Exact Mass
641.68800
H-Bond Acceptor
8
H-Bond Donor
2
What is the molecular formula of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The molecular formula is C16H2CaCl8O8.
What is the molecular weight of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The molecular weight is 645.9 g/mol.
What is the IUPAC name of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The IUPAC name is calcium;2-carboxy-3,4,5,6-tetrachlorobenzoate.
What is the InChI of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The InChI is InChI=1S/2C8H2Cl4O4.Ca/c2*9-3-1(7(13)14)2(8(15)16)4(10)6(12)5(3)11;/h2*(H,13,14)(H,15,16);/q;;+2/p-2.
What is the InChIKey of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The InChIKey is UORLIJOZQJVHRZ-UHFFFAOYSA-L.
What is the canonical SMILES of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The canonical SMILES is C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C(=O)O.C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C(=O)O.[Ca+2].
What is the CAS number of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The CAS number is 94275-90-8.
What is the European Community (EC) number of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The EC number is 304-478-4.
What is the hydrogen bond donor count of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The hydrogen bond donor count is 2.
What is the hydrogen bond acceptor count of Calcium hydrogen 3,4,5,6-tetrachlorophthalate?
The hydrogen bond acceptor count is 8.
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