Cas no 42862-36-2 (TRICYCLO[3.3.1.13,7]DECANE-1-CARBOXYLIC ACID)

TRICYCLO[3.3.1.13,7]DECANE-1-CARBOXYLIC ACID structure
42862-36-2 structure
Product Name:TRICYCLO[3.3.1.13,7]DECANE-1-CARBOXYLIC ACID
CAS No:42862-36-2
MF:C11H16O2
MW:180.243543624878
CID:3541518
PubChem ID:13235
Update Time:2025-04-22

TRICYCLO[3.3.1.13,7]DECANE-1-CARBOXYLIC ACID Chemical and Physical Properties

Names and Identifiers

    • TRICYCLO[3.3.1.13,7]DECANE-1-CARBOXYLIC ACID
    • adamantane 1-carboxylic acid
    • NS00042478
    • AKOS017344869
    • Tricyclo[3.3.1.1<3,7>]-decane-1-carboxylic acid
    • Tricyclo(3.3.1.1'3,7)decane-1-carboxylic acid
    • Adamantane1carboxylic acid
    • 3Adamantanecarboxylic acid
    • FS-2534
    • Tricyclo[3.3.1.1(3,7)-]decane-1-carboxylic acid
    • 1Adamantanecarboxylic acid (8CI)
    • AKOS005198690
    • DTXCID101505931
    • P21153
    • Adamantanecarboxylic acid
    • Adamantoic acid
    • Adamantylcarboxylic acid
    • SCHEMBL26217176
    • 1-Adamantanecarboxylic acid
    • F3095-4882
    • admantane carboxylic acid
    • GEO-04336
    • STK299270
    • NSC-94182
    • A0742
    • AKOS000119833
    • BDBM50111977
    • 1Carboxyadamantane
    • 1-Carboxyadamantane
    • DS-009693
    • Tricyclo(3.3.1.13,7)decane-1-carboxylic acid
    • 1-Adamantanecarboxylic Acid; 1-Adamantane-1-carboxylic Acid; 1-Adamantylcarboxylic Acid; 1-Carboxyadamantane; NSC 94182; Tricyclo[3.3.1.13,7]decane-1-carboxylic Acid
    • 1-adamantanecarboxylate (AC)
    • tricyclo[3.3.1.1~3,7~]decane-1-carboxylic acid
    • 1-adamantane carboxylic acid
    • adamantane carboxylic acid
    • NSC 94182
    • 1-admantanecarboxylic acid
    • MFCD00074720
    • NSC94182
    • 1-Adamantoic Acid
    • 1Adamantanecarboxylic acid
    • 1-Adamantanecarboxylic acid, 99%
    • BCP18124
    • CHEMBL170568
    • SCHEMBL19557168
    • (3R,5S,7s)-adamantane-1-carboxylic acid
    • EINECS 212-584-6
    • HMS1395K14
    • AN-632/40971698
    • PB33810
    • 42862-36-2
    • 1-Adamantane-1-carboxylic acid
    • 1-Adamantanecarboxylic Acid (purified by sublimation)
    • DB-003855
    • 1-adamantylcarboxylic acid
    • adamantanecarboxylate
    • BP-10550
    • Tricyclo(3.3.1.1(sup 3,7))decane1carboxylic acid
    • 828-51-3
    • Adamantane-1-carboxylic acid
    • DTXSID40870784
    • AS-14252
    • FA05474
    • SCHEMBL12714
    • Tricyclo3.3.1.13,7decane-1-carboxylic acid
    • Oprea1_849468
    • CHEMBL5186120
    • AI3-52431
    • NSC 193481
    • Tricyclo[3.3.1.13,7]-decane-1-carboxylic acid
    • EN300-16776
    • DTXSID901020894
    • 3-ADAMANTANECARBOXYLIC ACID
    • Labotest-bb lt00436929
    • 212-584-6
    • CS-W017189
    • SCHEMBL19557166
    • AC-10625
    • 1-Adamantanecarboxylic acid (8CI)
    • Tricyclo[3.3.1.13,7]-decane-2-carboxylic acid
    • InChI=1/C11H16O2/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2,(H,12,13
    • 2-Adamantane-1-carboxylic acid
    • (3r,5r,7r)-adamantane-1-carboxylic acid
    • Enamine_000586
    • 1-adamantyl carboxylic acid
    • Inchi： 1S/C11H16O2/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2,(H,12,13)
    • InChI Key： JIMXXGFJRDUSRO-UHFFFAOYSA-N
    • SMILES： OC(C12CC3CC(CC(C3)C1)C2)=O

Computed Properties

  • Exact Mass: 180.115029749Da
  • Monoisotopic Mass: 180.115029749Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 216
  • 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: 2.6
  • Topological Polar Surface Area: 37.3?2

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