CAS
96530-75-5 Purity
96%
96530-75-5 Purity
96%
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Isooctyl isoundecyl phthalate
CAS
96532-80-8
Catalog Number
ACM96532808
Category
Other Products
Molecular Weight
432.635860 [g/mol]
Molecular Formula
C27H44O4
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Specification
Synonyms
Isooctyl isoundecyl phthalate, EINECS 306-192-5, 96532-80-8
IUPAC Name
1-O-(9-methyldecyl) 2-O-(6-methylheptyl) benzene-1,2-dicarboxylate
Canonical SMILES
CC(C)CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC(C)C
InChI Key
ROPQCUSNKJJECC-UHFFFAOYSA-N
EC Number
306-192-5
Exact Mass
432.32400
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Isooctyl isoundecyl phthalate?
The molecular formula of Isooctyl isoundecyl phthalate is C27H44O4.
When was Isooctyl isoundecyl phthalate created in PubChem?
Isooctyl isoundecyl phthalate was created in PubChem on August 20, 2009.
What is the IUPAC Name of Isooctyl isoundecyl phthalate?
The IUPAC Name of Isooctyl isoundecyl phthalate is 1-O-(9-methyldecyl) 2-O-(6-methylheptyl) benzene-1,2-dicarboxylate.
What is the InChIKey of Isooctyl isoundecyl phthalate?
The InChIKey of Isooctyl isoundecyl phthalate is ROPQCUSNKJJECC-UHFFFAOYSA-N.
What is the molecular weight of Isooctyl isoundecyl phthalate?
The molecular weight of Isooctyl isoundecyl phthalate is 432.6 g/mol.
How many Hydrogen Bond Acceptor Count does Isooctyl isoundecyl phthalate have?
Isooctyl isoundecyl phthalate has 4 Hydrogen Bond Acceptor Count.
What is the Exact Mass of Isooctyl isoundecyl phthalate?
The Exact Mass of Isooctyl isoundecyl phthalate is 432.32395988 g/mol.
How many Rotatable Bond Count does Isooctyl isoundecyl phthalate have?
Isooctyl isoundecyl phthalate has 19 Rotatable Bond Count.
Is the Compound Is Canonicalized for Isooctyl isoundecyl phthalate?
Yes, the Compound Is Canonicalized for Isooctyl isoundecyl phthalate.
What is the Topological Polar Surface Area of Isooctyl isoundecyl phthalate?
The Topological Polar Surface Area of Isooctyl isoundecyl phthalate is 52.6Ų.
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