CAS
99991-93-2 Purity
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99991-93-2 Purity
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Geranyl-2-ethylbutyrate
CAS
99999-26-5
Catalog Number
ACM99999265
Category
Other Products
Molecular Weight
252.392320 [g/mol]
Molecular Formula
C16H28O2
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Specification
Synonyms
UNII-842I7XQG7D, Geranyl-2-ethylbutyrate, AC1NSG2J, FEMA No. 3339, 842I7XQG7D, SCHEMBL4543245, 73019-14-4, EINECS 277-234-7, EINECS 285-764-5, FT-0626682, 3,7-Dimethylocta-2,6-dienyl 2-ethylbutanoate, 3,7-Dimethyl-2,6-octadienyl 2-ethylbutanoate, (E)-, [(2E)-3,7-dimethylocta-2,6-dienyl] 2-ethylbutanoate, Butanoic acid, 2-ethyl-, (2E)-3,7-dimethyl-2,6-octadienyl ester, Butanoic acid, 2-ethyl-, 3,7-dimethyl-2,6-octadienyl ester, (E)-, 99999-26-5
IUPAC Name
[(2E)-3,7-dimethylocta-2,6-dienyl] 2-ethylbutanoate
Canonical SMILES
CCC(CC)C(=O)OCC=C(C)CCC=C(C)C
InChI Key
PFVYLGTZGQUUOT-SDNWHVSQSA-N
EC Number
277-234-7
Exact Mass
366.15800
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of Geranyl 2-ethylbutyrate?
The molecular formula of Geranyl 2-ethylbutyrate is C16H28O2.
When was Geranyl 2-ethylbutyrate created and last modified?
Geranyl 2-ethylbutyrate was created on August 8, 2005, and last modified on December 30, 2023.
What is the IUPAC name of Geranyl 2-ethylbutyrate?
The IUPAC name of Geranyl 2-ethylbutyrate is [(2E)-3,7-dimethylocta-2,6-dienyl] 2-ethylbutanoate.
What is the InChIKey of Geranyl 2-ethylbutyrate?
The InChIKey of Geranyl 2-ethylbutyrate is PFVYLGTZGQUUOT-SDNWHVSQSA-N.
How many hydrogen bond acceptors does Geranyl 2-ethylbutyrate have?
Geranyl 2-ethylbutyrate has 2 hydrogen bond acceptors.
What is the exact mass of Geranyl 2-ethylbutyrate?
The exact mass of Geranyl 2-ethylbutyrate is 252.208930132 g/mol.
How many rotatable bonds does Geranyl 2-ethylbutyrate have?
Geranyl 2-ethylbutyrate has 9 rotatable bonds.
What is the topological polar surface area of Geranyl 2-ethylbutyrate?
The topological polar surface area of Geranyl 2-ethylbutyrate is 26.3 Ų.
How many heavy atoms are present in Geranyl 2-ethylbutyrate?
Geranyl 2-ethylbutyrate has 18 heavy atoms.
What is the complexity value of Geranyl 2-ethylbutyrate?
The complexity value of Geranyl 2-ethylbutyrate is 292.
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