CAS
94201-68-0 Purity
96%
94201-68-0 Purity
96%
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2,6,10-Trimethylundeca-1,9-dien-4-yl acetate
CAS
94201-71-5
Catalog Number
ACM94201715
Category
Other Products
Molecular Weight
252.392320 [g/mol]
Molecular Formula
C16H28O2
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Specification
Synonyms
EINECS 303-660-0, CID3024002, 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate, 94201-71-5
IUPAC Name
2,6,10-trimethylundeca-1,9-dien-4-yl acetate
Canonical SMILES
CC(CCC=C(C)C)CC(CC(=C)C)OC(=O)C
InChI Key
CORWEQVTDUHIDS-UHFFFAOYSA-N
Boiling Point
322.4ºC at 760mmHg
Flash Point
94.3ºC
Density
0.884g/cm³
EC Number
303-660-0
Exact Mass
252.20900
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate?
The molecular formula is C16H28O2.
When was 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate first created and modified in PubChem?
It was first created on 2005-08-08 and last modified on 2023-12-30.
What is the IUPAC Name of 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate?
The IUPAC Name is 2,6,10-trimethylundeca-1,9-dien-4-yl acetate.
What is the InChI of 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate?
The InChI is InChI=1S/C16H28O2/c1-12(2)8-7-9-14(5)11-16(10-13(3)4)18-15(6)17/h8,14,16H,3,7,9-11H2,1-2,4-6H3.
What is the molecular weight of 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate?
The molecular weight is 252.39 g/mol.
How many hydrogen bond donor counts does 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate have?
It has 0 hydrogen bond donor counts.
What is the topological polar surface area of 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate?
The topological polar surface area is 26.3 Ų.
Is 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate a canonicalized compound?
Yes, it is canonicalized.
How many rotatable bond counts does 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate have?
It has 9 rotatable bond counts.
What is the XLogP3-AA value of 2,6,10-Trimethylundeca-1,9-dien-4-yl acetate?
The XLogP3-AA value is 5.6.
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