CAS
94088-09-2 Purity
96%
94088-09-2 Purity
96%
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(1E,6Z)-1-Ethoxynona-1,6-diene
CAS
94088-11-6
Catalog Number
ACM94088116
Category
Other Products
Molecular Weight
168.275900 [g/mol]
Molecular Formula
C11H20O
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Specification
Synonyms
(1E,6Z)-1-Ethoxynona-1,6-diene, 94088-11-6, CTK5H4871, AG-H-86700
IUPAC Name
1-ethoxynona-1,6-diene
Canonical SMILES
CCC=CCCCC=COCC
InChI Key
QMZAWOWCSLVFKC-UHFFFAOYSA-N
Boiling Point
236ºC at 760mmHg
Flash Point
54.7ºC
Density
0.826g/cm³
EC Number
302-008-2
Exact Mass
168.15100
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of the compound with PubChem CID 20836305?
The molecular formula is C11H20O.
When was the compound first created in PubChem?
The compound was first created on December 5, 2007.
What is the IUPAC name of the compound?
The IUPAC name is (1E,6Z)-1-ethoxynona-1,6-diene.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES representation is CCC=CCCCC=COCC.
What is the InChIKey of the compound?
The InChIKey is QMZAWOWCSLVFKC-GWZUCBFCSA-N.
What is the CAS number of the compound?
The CAS number is 94088-11-6.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 3.6.
How many Rotatable Bond Count does the compound have?
The compound has 7 Rotatable Bond Count.
What is the Heavy Atom Count of the compound?
The Heavy Atom Count is 12.
Is the Compound Canonicalized according to PubChem?
Yes, the Compound is Canonicalized according to PubChem.
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