Cas no 2227742-14-3 ((2S)-4-(adamantan-1-yl)butan-2-ol)

(2S)-4-(Adamantan-1-yl)butan-2-ol is a chiral secondary alcohol featuring an adamantyl group, a rigid polycyclic hydrocarbon known for enhancing steric and electronic properties in molecular design. This compound is valued for its structural stability and potential as a synthetic intermediate in pharmaceuticals, agrochemicals, and materials science. The adamantyl moiety imparts lipophilicity and metabolic resistance, while the stereocenter at the 2-position allows for enantioselective applications. Its well-defined stereochemistry makes it suitable for asymmetric synthesis and chiral derivatization. The compound’s robustness and modularity render it useful in medicinal chemistry for probing structure-activity relationships or as a scaffold in drug discovery.
(2S)-4-(adamantan-1-yl)butan-2-ol structure
2227742-14-3 structure
Product Name:(2S)-4-(adamantan-1-yl)butan-2-ol
CAS No:2227742-14-3
MF:C14H24O
MW:208.339764595032
CID:5858752
PubChem ID:125503148
Update Time:2025-06-09

(2S)-4-(adamantan-1-yl)butan-2-ol Chemical and Physical Properties

Names and Identifiers

    • (2S)-4-(adamantan-1-yl)butan-2-ol
    • EN300-1797514
    • 2227742-14-3
    • Inchi: 1S/C14H24O/c1-10(15)2-3-14-7-11-4-12(8-14)6-13(5-11)9-14/h10-13,15H,2-9H2,1H3/t10-,11?,12?,13?,14?/m0/s1
    • InChI Key: HMAAOLVDLNRSLH-MWKHJINRSA-N
    • SMILES: O[C@@H](C)CCC12CC3CC(CC(C3)C1)C2

Computed Properties

  • Exact Mass: 208.182715385g/mol
  • Monoisotopic Mass: 208.182715385g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 204
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.1
  • Topological Polar Surface Area: 20.2?2

(2S)-4-(adamantan-1-yl)butan-2-ol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1797514-1g
(2S)-4-(adamantan-1-yl)butan-2-ol
2227742-14-3
1g
$1515.0 2023-09-19
Enamine
EN300-1797514-5g
(2S)-4-(adamantan-1-yl)butan-2-ol
2227742-14-3
5g
$4391.0 2023-09-19
Enamine
EN300-1797514-10g
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2227742-14-3
10g
$6512.0 2023-09-19
Enamine
EN300-1797514-0.05g
(2S)-4-(adamantan-1-yl)butan-2-ol
2227742-14-3
0.05g
$1272.0 2023-09-19
Enamine
EN300-1797514-0.1g
(2S)-4-(adamantan-1-yl)butan-2-ol
2227742-14-3
0.1g
$1332.0 2023-09-19
Enamine
EN300-1797514-0.25g
(2S)-4-(adamantan-1-yl)butan-2-ol
2227742-14-3
0.25g
$1393.0 2023-09-19
Enamine
EN300-1797514-0.5g
(2S)-4-(adamantan-1-yl)butan-2-ol
2227742-14-3
0.5g
$1453.0 2023-09-19
Enamine
EN300-1797514-1.0g
(2S)-4-(adamantan-1-yl)butan-2-ol
2227742-14-3
1g
$1515.0 2023-06-03
Enamine
EN300-1797514-2.5g
(2S)-4-(adamantan-1-yl)butan-2-ol
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2.5g
$2969.0 2023-09-19
Enamine
EN300-1797514-5.0g
(2S)-4-(adamantan-1-yl)butan-2-ol
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