CAS
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97232-16-1 Purity
98%
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Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate
CAS
97233-28-8
Catalog Number
ACM97233288
Category
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What is the molecular formula of Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate?
The molecular formula is C14H22ClNO3.
What is the molecular weight of Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate?
The molecular weight is 287.78 g/mol.
What is the IUPAC name of Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate?
The IUPAC name is (2S)-2-(4-chloro-2-methylphenoxy)propanoate;diethylazanium.
What is the InChI of Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate?
The InChI is InChI=1S/C10H11ClO3.C4H11N/c1-6-5-8(11)3-4-9(6)14-7(2)10(12)13;1-3-5-4-2/h3-5,7H,1-2H3,(H,12,13);5H,3-4H2,1-2H3/t7-;/m0./s1.
What is the InChIKey of Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate?
The InChIKey is YWWMOSBBXLVHSK-FJXQXJEOSA-N.
What is the canonical SMILES of Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate?
The canonical SMILES is CC[NH2+]CC.CC1=C(C=CC(=C1)Cl)OC(C)C(=O)[O-].
How many hydrogen bond donor count does Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate have?
It has 1 hydrogen bond donor count.
How many hydrogen bond acceptor count does Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate have?
It has 3 hydrogen bond acceptor count.
How many rotatable bond count does Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate have?
It has 4 rotatable bond count.
What is the CAS number of Diethylammonium(S)-2-(4-chloro-2-methylphenoxy)propionate?
The CAS number is 97233-28-8.
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