Cas no 113249-47-1 (4-(adamantan-1-yl)butan-2-one)

4-(adamantan-1-yl)butan-2-one structure
4-(adamantan-1-yl)butan-2-one structure
Product Name:4-(adamantan-1-yl)butan-2-one
CAS No:113249-47-1
MF:C14H22O
MW:206.323884487152
CID:2880051
PubChem ID:15709684
Update Time:2025-04-21

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

Names and Identifiers

    • 4-(adamantan-1-yl)butan-2-one
    • 113249-47-1
    • SCHEMBL13780945
    • EN300-1797851
    • Inchi: 1S/C14H22O/c1-10(15)2-3-14-7-11-4-12(8-14)6-13(5-11)9-14/h11-13H,2-9H2,1H3
    • InChI Key: UQOSBIKTLKNGGM-UHFFFAOYSA-N
    • SMILES: O=C(C)CCC12CC3CC(CC(C3)C1)C2

Computed Properties

  • Exact Mass: 206.167065321Da
  • Monoisotopic Mass: 206.167065321Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 238
  • 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: 3.7
  • Topological Polar Surface Area: 17.1?2

4-(adamantan-1-yl)butan-2-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1797851-0.05g
4-(adamantan-1-yl)butan-2-one
113249-47-1
0.05g
$780.0 2023-09-19
Enamine
EN300-1797851-0.1g
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$817.0 2023-09-19
Enamine
EN300-1797851-0.25g
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113249-47-1
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$855.0 2023-09-19
Enamine
EN300-1797851-0.5g
4-(adamantan-1-yl)butan-2-one
113249-47-1
0.5g
$891.0 2023-09-19
Enamine
EN300-1797851-1.0g
4-(adamantan-1-yl)butan-2-one
113249-47-1
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$928.0 2023-06-02
Enamine
EN300-1797851-2.5g
4-(adamantan-1-yl)butan-2-one
113249-47-1
2.5g
$1819.0 2023-09-19
Enamine
EN300-1797851-5.0g
4-(adamantan-1-yl)butan-2-one
113249-47-1
5g
$2692.0 2023-06-02
Enamine
EN300-1797851-10.0g
4-(adamantan-1-yl)butan-2-one
113249-47-1
10g
$3992.0 2023-06-02
Enamine
EN300-1797851-1g
4-(adamantan-1-yl)butan-2-one
113249-47-1
1g
$928.0 2023-09-19
Enamine
EN300-1797851-5g
4-(adamantan-1-yl)butan-2-one
113249-47-1
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$2692.0 2023-09-19
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