3-Butenoic acid, 3-methyl-4-phenyl-, sodium salt (1:1)
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3-Butenoic acid, 3-methyl-4-phenyl-, sodium salt (1:1)
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CAS No:
19488-17-6
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Formula:
C11H12O2.Na
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Chemical Name:
3-Butenoic acid, 3-methyl-4-phenyl-, sodium salt (1:1)
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Synonyms:
3-Butenoic acid,3-methyl-4-phenyl-,sodium salt (1:1);3-Butenoic acid,3-methyl-4-phenyl-,sodium salt;Sodium β-benzalbutyrate
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CAS No:
3-Butenoic acid, 3-methyl-4-phenyl-, sodium salt (1:1) Basic Attributes
198.19400
199.07349890
243-109-0
Computed Properties
Molecular Weight:199.20
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:199.07349890
Monoisotopic Mass:199.07349890
Topological Polar Surface Area:37.3
Heavy Atom Count:14
Formal Charge:1
Complexity:200
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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