CAS
94200-05-2 Purity
96%
94200-05-2 Purity
96%
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2-Ethylheptyl propionate
CAS
94200-08-5
Catalog Number
ACM94200085
Category
Other Products
Molecular Weight
200.317760 [g/mol]
Molecular Formula
C12H24O2
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Specification
Synonyms
2-Ethylheptyl propionate, EINECS 303-484-4, CID3023948, 94200-08-5
IUPAC Name
2-ethylheptyl propanoate
Canonical SMILES
CCCCCC(CC)COC(=O)CC
InChI Key
WTLXVOXPXAHOIU-UHFFFAOYSA-N
Boiling Point
231.9ºC at 760mmHg
Flash Point
94ºC
Density
0.869g/cm³
EC Number
303-484-4
Exact Mass
200.17800
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 2-Ethylheptyl propionate?
The molecular formula of 2-Ethylheptyl propionate is C12H24O2.
What is the molecular weight of 2-Ethylheptyl propionate?
The molecular weight of 2-Ethylheptyl propionate is 200.32 g/mol.
When was 2-Ethylheptyl propionate created?
2-Ethylheptyl propionate was created on August 8, 2005.
What is the IUPAC name of 2-Ethylheptyl propionate?
The IUPAC name of 2-Ethylheptyl propionate is 2-ethylheptyl propanoate.
What is the InChIKey of 2-Ethylheptyl propionate?
The InChIKey of 2-Ethylheptyl propionate is WTLXVOXPXAHOIU-UHFFFAOYSA-N.
What is the Canonical SMILES of 2-Ethylheptyl propionate?
The Canonical SMILES of 2-Ethylheptyl propionate is CCCCCC(CC)COC(=O)CC.
How many hydrogen bond acceptors does 2-Ethylheptyl propionate have?
2-Ethylheptyl propionate has 2 hydrogen bond acceptors.
What is the XLogP3-AA value of 2-Ethylheptyl propionate?
The XLogP3-AA value of 2-Ethylheptyl propionate is 4.3.
Does 2-Ethylheptyl propionate have any defined atom stereocenters?
No, 2-Ethylheptyl propionate does not have any defined atom stereocenters.
Is 2-Ethylheptyl propionate considered a canonical compound?
Yes, 2-Ethylheptyl propionate is considered a canonical compound.
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