CAS
93857-81-9 Purity
96%
93857-81-9 Purity
96%
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Butanoic acid,3-methyl-,3-cyclohexylpropyl ester
CAS
93857-92-2
Catalog Number
ACM93857922
Category
Other Products
Molecular Weight
226.35504
Molecular Formula
C14H26O2
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Specification
Density
0.916g/cm³
What is the molecular formula of Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester?
The molecular formula is C14H26O2.
When was Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester created and modified in PubChem?
It was created on 2005-08-08 and last modified on 2023-12-30.
What is the IUPAC Name of Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester?
The IUPAC Name is 3-cyclohexylpropyl 3-methylbutanoate.
What is the InChIKey of Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester?
The InChIKey is UBRSOJDKMYAROK-UHFFFAOYSA-N.
What is the Canonical SMILES of Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester?
The Canonical SMILES is CC(C)CC(=O)OCCCC1CCCCC1.
What is the molecular weight of Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester?
The molecular weight is 226.35 g/mol.
How many hydrogen bond acceptors does Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester have?
It has 2 hydrogen bond acceptors.
What is the exact mass of Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester?
The exact mass is 226.193280068 g/mol.
How many rotatable bond counts does Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester have?
It has 7 rotatable bond counts.
Is Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester canonicalized in PubChem?
Yes, it is compound is canonicalized in PubChem.
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