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96%
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2-Methylcyclohexyl palmitate
CAS
97635-30-8
Catalog Number
ACM97635308
Category
Other Products
Molecular Weight
352.594260 [g/mol]
Molecular Formula
C23H44O2
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Specification
Synonyms
2-Methylcyclohexyl palmitate, EINECS 307-392-5, CID3024983, 97635-30-8
IUPAC Name
(2-methylcyclohexyl) hexadecanoate
Canonical SMILES
CCCCCCCCCCCCCCCC(=O)OC1CCCCC1C
InChI Key
HEJYYMALYZHULQ-UHFFFAOYSA-N
Boiling Point
402.7ºC at 760 mmHg
Flash Point
216.5ºC
Density
0.9g/cm³
EC Number
307-392-5
Exact Mass
352.33400
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 2-Methylcyclohexyl palmitate?
The molecular formula of 2-Methylcyclohexyl palmitate is C23H44O2.
When was 2-Methylcyclohexyl palmitate created and last modified?
2-Methylcyclohexyl palmitate was created on August 8, 2005, and last modified on December 30, 2023.
What is the IUPAC name of 2-Methylcyclohexyl palmitate?
The IUPAC name of 2-Methylcyclohexyl palmitate is (2-methylcyclohexyl) hexadecanoate.
What is the InChIKey of 2-Methylcyclohexyl palmitate?
The InChIKey of 2-Methylcyclohexyl palmitate is HEJYYMALYZHULQ-UHFFFAOYSA-N.
What is the canonical SMILES representation of 2-Methylcyclohexyl palmitate?
The canonical SMILES representation of 2-Methylcyclohexyl palmitate is CCCCCCCCCCCCCCCC(=O)OC1CCCCC1C.
What is the molecular weight of 2-Methylcyclohexyl palmitate?
The molecular weight of 2-Methylcyclohexyl palmitate is 352.6 g/mol.
How many hydrogen bond acceptor counts are there in 2-Methylcyclohexyl palmitate?
There are 2 hydrogen bond acceptor counts in 2-Methylcyclohexyl palmitate.
What is the topological polar surface area of 2-Methylcyclohexyl palmitate?
The topological polar surface area of 2-Methylcyclohexyl palmitate is 26.3 Å2.
Is the compound canonicalized?
Yes, the compound is canonicalized.
How many rotatable bond counts are there in 2-Methylcyclohexyl palmitate?
There are 16 rotatable bond counts in 2-Methylcyclohexyl palmitate.
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