Cas no 59744-46-6 ((3Z)-4-phenylbut-3-enoic acid)

(3Z)-4-Phenylbut-3-enoic acid is a chiral unsaturated carboxylic acid featuring a phenyl substituent on a butenoic acid backbone. Its (Z)-configuration confers distinct steric and electronic properties, making it valuable as an intermediate in organic synthesis, particularly for stereoselective reactions. The compound’s conjugated system enhances reactivity in Michael additions or cycloadditions, while the carboxylic acid group allows for further functionalization via esterification or amidation. Its structural features are useful in pharmaceutical and agrochemical research, where precise control over olefin geometry is critical. High purity grades ensure reproducibility in applications such as asymmetric catalysis or polymer modification. Storage under inert conditions is recommended to preserve the (Z)-alkene integrity.
(3Z)-4-phenylbut-3-enoic acid structure
(3Z)-4-phenylbut-3-enoic acid structure
Product Name:(3Z)-4-phenylbut-3-enoic acid
CAS No:59744-46-6
MF:C10H10O2
MW:162.185203075409
MDL:MFCD30550876
CID:337434
PubChem ID:6436799
Update Time:2025-10-29

(3Z)-4-phenylbut-3-enoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Butenoic acid, 4-phenyl-, (Z)-
    • (3Z)-4-phenylbut-3-enoic acid
    • 59744-46-6
    • SCHEMBL582727
    • (3Z)-4-phenyl-3-butenoic acid
    • (z)-4-phenyl-but-3-enoic acid
    • NSC172584
    • NSC 172584
    • 3-Butenoic acid, 4-phenyl-, (3Z)-
    • (Z)-4-phenylbut-3-enoicacid
    • UNII-77ZO6UV6WY
    • NSC-172584
    • (E)-4-Phenyl-3-butenoic acid
    • 3-Butenoic acid, 4-phenyl-, (E)-
    • 34WSP69ABK
    • (Z)-4-phenylbut-3-enoic acid
    • Q27266616
    • UNII-34WSP69ABK
    • 77ZO6UV6WY
    • MDL： MFCD30550876
    • Inchi： 1S/C10H10O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-7H,8H2,(H,11,12)/b7-4-
    • InChI Key： PSCXFXNEYIHJST-DAXSKMNVSA-N
    • SMILES： OC(C/C=C\C1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 162.0681
  • Monoisotopic Mass: 162.068079557g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 167
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3

(3Z)-4-phenylbut-3-enoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-342495-1.0g
(3Z)-4-phenylbut-3-enoic acid
 59744-46-6
1.0g
 $0.0 2023-02-23
Enamine
EN300-342495-1g
(3Z)-4-phenylbut-3-enoic acid
 59744-46-6
1g
 $0.0 2023-09-03

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