Cas no 105254-44-2 (4-Pentylbenzylamine)

4-Pentylbenzylamine structure
4-Pentylbenzylamine structure
Product Name:4-Pentylbenzylamine
CAS No:105254-44-2
MF:C12H19N
MW:177.28596329689
CID:126654
PubChem ID:2775785
Update Time:2025-04-18

4-Pentylbenzylamine Chemical and Physical Properties

Names and Identifiers

    • Benzenemethanamine,4-pentyl-
    • 4-N-PENTYLBENZYLAMINE
    • 4-pentyl-benzylamine
    • 4-Pentylbenzylamine
    • Benzylamine,p-pentyl- (6CI)
    • 105254-44-2
    • QIEDWVJRICQSAL-UHFFFAOYSA-N
    • (4-pentylphenyl)methanamine
    • SCHEMBL395434
    • Maybridge1_002471
    • DivK1c_001223
    • AKOS006228692
    • CDS1_000183
    • Inchi: 1S/C12H19N/c1-2-3-4-5-11-6-8-12(10-13)9-7-11/h6-9H,2-5,10,13H2,1H3
    • InChI Key: QIEDWVJRICQSAL-UHFFFAOYSA-N
    • SMILES: NCC1C=CC(=CC=1)CCCCC

Computed Properties

  • Exact Mass: 177.15187
  • Monoisotopic Mass: 177.152
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 5
  • Complexity: 114
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.2
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • Density: 0.924±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 120 oC (26 Torr)
  • Flash Point: 124.8±6.3 oC,
  • Solubility: Very slightly soluble (0.32 g/l) (25 o C),
  • PSA: 26.02
  • LogP: 3.57830

4-Pentylbenzylamine Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
P279813-25mg
4-Pentylbenzylamine
105254-44-2
25mg
$ 50.00 2022-06-03
TRC
P279813-50mg
4-Pentylbenzylamine
105254-44-2
50mg
$ 65.00 2022-06-03
TRC
P279813-200mg
4-Pentylbenzylamine
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200mg
$ 185.00 2022-06-03
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