CAS
93777-39-0 Purity
96%
93777-39-0 Purity
96%
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Octyl 2-ethylhexanoate
CAS
93777-45-8
Catalog Number
ACM93777458
Category
Other Products
Molecular Weight
256.424080 [g/mol]
Molecular Formula
C16H32O2
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Specification
Synonyms
Octyl 2-ethylhexanoate, EINECS 298-077-0, CID546488, Hexanoic acid, 2-ethyl-, octyl ester, 93777-45-8
IUPAC Name
octyl 2-ethylhexanoate
SMILES
CCCCCCCCOC(=O)C(CC)CCCC
InChI Key
LGCQCKHJCZIRTE-UHFFFAOYSA-N
Boiling Point
296.8ºC at 760mmHg
Flash Point
134.7ºC
Density
0.864g/cm³
EC Number
298-077-0
Exact Mass
256.24000
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of Octyl 2-ethylhexanoate?
The molecular formula of Octyl 2-ethylhexanoate is C16H32O2.
What is the molecular weight of Octyl 2-ethylhexanoate?
The molecular weight of Octyl 2-ethylhexanoate is 256.42 g/mol.
What is the IUPAC name of Octyl 2-ethylhexanoate?
The IUPAC name of Octyl 2-ethylhexanoate is octyl 2-ethylhexanoate.
What is the InChI code for Octyl 2-ethylhexanoate?
The InChI code for Octyl 2-ethylhexanoate is InChI=1S/C16H32O2/c1-4-7-9-10-11-12-14-18-16(17)15(6-3)13-8-5-2/h15H,4-14H2,1-3H3.
What is the InChIKey of Octyl 2-ethylhexanoate?
The InChIKey of Octyl 2-ethylhexanoate is LGCQCKHJCZIRTE-UHFFFAOYSA-N.
What is the canonical SMILES of Octyl 2-ethylhexanoate?
The canonical SMILES of Octyl 2-ethylhexanoate is CCCCCCCCOC(=O)C(CC)CCCC.
What is the CAS number of Octyl 2-ethylhexanoate?
The CAS number of Octyl 2-ethylhexanoate is 93777-45-8.
What is the European Community (EC) number of Octyl 2-ethylhexanoate?
The European Community (EC) number of Octyl 2-ethylhexanoate is 298-077-0.
What is the XLogP3-AA value of Octyl 2-ethylhexanoate?
The XLogP3-AA value of Octyl 2-ethylhexanoate is 6.4.
Is Octyl 2-ethylhexanoate a canonicalized compound?
Yes, Octyl 2-ethylhexanoate is a canonicalized compound according to PubChem.
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