D-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
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D-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
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CAS No:
41036-32-2
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Formula:
C10H13NO2.C7H8O3S
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Chemical Name:
D-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
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Synonyms:
D-Alanine,phenylmethyl ester,4-methylbenzenesulfonate (1:1);D-Alanine,phenylmethyl ester,4-methylbenzenesulfonate;D-Alanine benzyl ester p-toluenesulfonate;Benzyl D-alaninate p-toluenesulfonate;D-Alanine benzyl ester tosylate;D-Alanine benzyl ester p-toluenesulfonate salt;O-Benzyl-D-alanine toluene-p-sulfonate
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CAS No:
D-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1) Basic Attributes
351.42
351.114044
255-185-2
2922499990
D-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1) Use and Manufacturing
A benzoxazine derivatives as modulators of chemokine receptors for treatment of inflammatory and immunoregulatory diseases.
Computed Properties
Molecular Weight:351.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:351.11404394
Monoisotopic Mass:351.11404394
Topological Polar Surface Area:115
Heavy Atom Count:24
Complexity:371
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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