CAS
93777-70-9 Purity
96%
93777-70-9 Purity
96%
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4-Octadecyl-o-cresol
CAS
93777-76-5
Catalog Number
ACM93777765
Category
Other Products
Molecular Weight
360.616260 [g/mol]
Molecular Formula
C25H44O
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Specification
Synonyms
4-Octadecyl-o-cresol, EINECS 298-110-9, CID3022311, 93777-76-5
IUPAC Name
2-methyl-4-octadecylphenol
Canonical SMILES
CCCCCCCCCCCCCCCCCCC1=CC(=C(C=C1)O)C
InChI Key
YZNQWZJMXAWHAO-UHFFFAOYSA-N
Boiling Point
470.4ºC at 760mmHg
Flash Point
221.6ºC
Density
0.899g/cm³
EC Number
298-110-9
Exact Mass
360.33900
H-Bond Acceptor
1
H-Bond Donor
1
What is the molecular formula of 4-Octadecyl-o-cresol?
The molecular formula is C25H44O.
When was 4-Octadecyl-o-cresol initially created in PubChem?
It was created on 2005-08-08.
What is the IUPAC name of 4-Octadecyl-o-cresol?
The IUPAC name is 2-methyl-4-octadecylphenol.
What is the molecular weight of 4-Octadecyl-o-cresol?
The molecular weight is 360.6 g/mol.
What is the InChIKey of 4-Octadecyl-o-cresol?
The InChIKey is YZNQWZJMXAWHAO-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 4-Octadecyl-o-cresol have?
It has 1 hydrogen bond donor count.
What is the XLogP3 value of 4-Octadecyl-o-cresol?
The XLogP3 value is 11.4.
How many rotatable bond counts does 4-Octadecyl-o-cresol have?
It has 17 rotatable bond counts.
Is 4-Octadecyl-o-cresol the canonicalized compound?
Yes, 4-Octadecyl-o-cresol is canonicalized.
What is the topological polar surface area of 4-Octadecyl-o-cresol?
The topological polar surface area is 20.2 Å2.
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