CAS
97635-42-2 Purity
96%
97635-42-2 Purity
96%
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2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate
CAS
97635-45-5
Catalog Number
ACM97635455
Category
Other Products
Molecular Weight
304.212160 [g/mol]
Molecular Formula
C14H19Cl2NO2
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Specification
Synonyms
EINECS 307-405-4, CID175711, 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate, 97635-45-5
IUPAC Name
2-ethylhexyl 3,6-dichloropyridine-2-carboxylate
Canonical SMILES
CCCCC(CC)COC(=O)C1=C(C=CC(=N1)Cl)Cl
InChI Key
BOOFNDJFNWCPQD-UHFFFAOYSA-N
Boiling Point
387.8ºC at 760mmHg
Flash Point
188.3ºC
Density
1.168g/cm³
EC Number
307-405-4
Exact Mass
303.07900
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate?
The molecular formula is C14H19Cl2NO2.
When was 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate first created?
It was created on August 9, 2005.
What is the molecular weight of 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate?
The molecular weight is 304.2 g/mol.
What is the InChIKey of 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate?
The InChIKey is BOOFNDJFNWCPQD-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate have?
It has 0 hydrogen bond donor counts.
What is the topological polar surface area of 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate?
The topological polar surface area is 39.2 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
How many rotatable bond counts does 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate have?
It has 8 rotatable bond counts.
What is the XLogP3-AA value of 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate?
The XLogP3-AA value is 5.8.
What is the CAS number of 2-Ethylhexyl 3,6-dichloropyridine-2-carboxylate?
The CAS number is 97635-45-5.
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