CAS
93858-62-9 Purity
96%
93858-62-9 Purity
96%
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Barium 4,4-diethoxy-2,3-dihydroxybutyl phosphate
CAS
93858-65-2
Catalog Number
ACM93858652
Category
Other Products
Molecular Weight
409.516542 [g/mol]
Molecular Formula
C8H17BaO8P
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Specification
Synonyms
Barium 4,4-diethoxy-2,3-dihydroxybutyl phosphate, 93858-65-2, CTK5H3604, EINECS 299-298-5, AG-H-84348
IUPAC Name
barium(2+);(4,4-diethoxy-2,3-dihydroxybutyl) phosphate
InChI Key
CSWHLSBLRHSZCG-UHFFFAOYSA-L
Exact Mass
409.97100
H-Bond Acceptor
8
H-Bond Donor
2
What is the molecular formula of the compound containing Barium 4,4-diethoxy-2,3-dihydroxybutyl phosphate?
The molecular formula is C8H17BaO8P.
When was the compound created and modified?
It was created on 2009-08-20 and modified on 2023-12-30.
What is the IUPAC Name of the compound?
The IUPAC Name is barium(2+);(4,4-diethoxy-2,3-dihydroxybutyl) phosphate.
What is the InChIKey of the compound?
The InChIKey is CSWHLSBLRHSZCG-UHFFFAOYSA-L.
What is the Canonical SMILES of the compound?
The Canonical SMILES is CCOC(C(C(COP(=O)([O-])[O-])O)O)OCC.[Ba+2].
What is the molecular weight of the compound?
The molecular weight is 409.52 g/mol.
How many Hydrogen Bond Donors does the compound have?
It has 2 Hydrogen Bond Donor Counts.
What is the Topological Polar Surface Area of the compound?
The Topological Polar Surface Area is 131 Ų.
How many Heavy Atoms are present in the compound?
There are 18 Heavy Atoms present in the compound.
Is the Compound Canonicalized?
Yes, the compound is canonicalized.
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