Cas no 18382-99-5 (1-[(4-methylphenyl)methyl]cyclopropane-1-carboxylic Acid)

1-[(4-methylphenyl)methyl]cyclopropane-1-carboxylic Acid structure
18382-99-5 structure
Product Name:1-[(4-methylphenyl)methyl]cyclopropane-1-carboxylic Acid
CAS No:18382-99-5
MF:C20H26O2
MW:298.419246196747
CID:1377925
PubChem ID:257430
Update Time:2025-04-20

1-[(4-methylphenyl)methyl]cyclopropane-1-carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 1-[(4-methylphenyl)methyl]cyclopropane-1-carboxylic Acid
    • Assimil
    • Anabo
    • Andoron
    • Preroide
    • RU 143
    • Methybol
    • Prohormo
    • Tantaron
    • Antalone
    • Duramin
    • Assimil; Anabo; Andoron; Preroide; RU 143; Methybol; Prohormo; Tantaron; Antalone; Duramin;
    • NSC-85444
    • 18382-99-5
    • NSC85444
    • Inchi: 1S/C20H26O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h6-7,9,12,15,17,22H,4-5,8,10-11H2,1-3H3/t15-,17+,18+,19+,20+/m1/s1
    • InChI Key: PKRPUUPBMOSRJY-HTDHLNIYSA-N
    • SMILES: O[C@@]1(C)CC[C@H]2[C@@H]3CCC4=CC(C=C[C@]4(C)C3=CC[C@@]21C)=O

Computed Properties

  • Exact Mass: 190.09942
  • Monoisotopic Mass: 298.193280068g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 0
  • Complexity: 640
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3
  • LogP: 3.96540

1-[(4-methylphenyl)methyl]cyclopropane-1-carboxylic Acid Related Literature

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