(R)-3-Benzyl-4-methoxy-4-oxobutanoic acid
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(R)-3-Benzyl-4-methoxy-4-oxobutanoic acid
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CAS No:
119807-84-0
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Formula:
C12H14O4
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Chemical Name:
(R)-3-Benzyl-4-methoxy-4-oxobutanoic acid
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Synonyms:
(R)-(+)-2-BENZYLSUCCINIC ACID 1-METHYL ESTER; (R)-2-Benzylsuccinic acid-1-methyl ester;
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CAS No:
Characteristics
63.60000
1.49300
1.19g/cm3
364.728ºC at 760 mmHg
138.768ºC
1.529
Refrigerator (+4ºC)
0mmHg at 25°C
Computed Properties
Molecular Weight:222.24
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:222.08920892
Monoisotopic Mass:222.08920892
Topological Polar Surface Area:63.6
Heavy Atom Count:16
Complexity:243
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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