1-Methyl (2S)-2-(2-naphthalenylmethyl)butanedioate
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1-Methyl (2S)-2-(2-naphthalenylmethyl)butanedioate
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CAS No:
220497-75-6
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Formula:
C16H16O4
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Chemical Name:
1-Methyl (2S)-2-(2-naphthalenylmethyl)butanedioate
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Synonyms:
Butanedioic acid,2-(2-naphthalenylmethyl)-,1-methyl ester,(2S)-;Butanedioic acid,(2-naphthalenylmethyl)-,1-methyl ester,(2S)-;1-Methyl (2S)-2-(2-naphthalenylmethyl)butanedioate;(S)-2-(2-Naphthylmethyl)succinic acid 1-methyl ester;(S)-4-Methoxy-3-(naphthalen-2-ylmethyl)-4-oxobutanoic acid
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CAS No:
Characteristics
63.60000
2.64620
64.7ºC
458.7ºC at 760mmHg
170.6ºC
Refrigerator (+4ºC)
3.31E-09mmHg at 25°C
Computed Properties
Molecular Weight:272.29
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:272.10485899
Monoisotopic Mass:272.10485899
Topological Polar Surface Area:63.6
Heavy Atom Count:20
Complexity:352
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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