Methyl (2E,4S)-4-(benzyloxy)-2-pentenoate
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Methyl (2E,4S)-4-(benzyloxy)-2-pentenoate
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CAS No:
112489-57-3
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Formula:
C13H16O3
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Chemical Name:
Methyl (2E,4S)-4-(benzyloxy)-2-pentenoate
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Synonyms:
methyl (2E)-(4S)-4-benzyloxypent-2-enoate; (E)-(S)-[MeCH(OCH2C6H5)CHCHCO2Me]; Methyl-6-oxo-2,4-trans,trans-heptadienoat; methyl 6-oxo-2(E),4(E)-heptadienoate; 2,4-Heptadienoic acid,6-oxo-,methyl ester,(Z,Z); 2,4-Heptadienoic acid,6-oxo-,methyl ester,(E,Z); (2E,4E)-6-Oxohepta-2,4-diensaeure-methylester; methyl (2E,4E)-6-oxohepta-2,4-dienoate;Expand
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CAS No:
Characteristics
35.53000
2.32090
1.055g/cm3
311.8ºC at 760mmHg
127.5ºC
1.511
Refrigerator (+4ºC)
0.000552mmHg at 25°C
Computed Properties
Molecular Weight:220.26
XLogP3:2.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:220.109944368
Monoisotopic Mass:220.109944368
Topological Polar Surface Area:35.5
Heavy Atom Count:16
Complexity:229
Defined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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