Cas no 5561-13-7 (Bicyclo[4.1.0]heptan-2-ol, 3,7,7-trimethyl-, (1S,2R,3S,6R)-)

Bicyclo[4.1.0]heptan-2-ol, 3,7,7-trimethyl-, (1S,2R,3S,6R)- structure
5561-13-7 structure
Product Name:Bicyclo[4.1.0]heptan-2-ol, 3,7,7-trimethyl-, (1S,2R,3S,6R)-
CAS No:5561-13-7
MF:C10H18O
MW:154.249323368073
CID:351390
PubChem ID:11040909
Update Time:2025-04-19

Bicyclo[4.1.0]heptan-2-ol, 3,7,7-trimethyl-, (1S,2R,3S,6R)- Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[4.1.0]heptan-2-ol, 3,7,7-trimethyl-, (1S,2R,3S,6R)-
    • (1R,4S,5R,6S)-4,7,7-trimethylbicyclo[4.1.0]heptan-5-ol
    • 5561-13-7
    • DTXSID60452905
    • CTK1F6473
    • Inchi: 1S/C10H18O/c1-6-4-5-7-8(9(6)11)10(7,2)3/h6-9,11H,4-5H2,1-3H3/t6-,7+,8+,9+/m0/s1
    • InChI Key: RPPLFPVIBFQGJC-JQCXWYLXSA-N
    • SMILES: O[C@@H]1[C@@H](C)CC[C@H]2C(C)(C)[C@H]21

Computed Properties

  • Exact Mass: 154.13584
  • Monoisotopic Mass: 154.135765193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 174
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.6
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23
Recommended suppliers
Inner Mongolia Xinhong Biological Technology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Inner Mongolia Xinhong Biological Technology Co., Ltd
Shanghai Jinhuan Chemical CO., LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Jinhuan Chemical CO., LTD.
Jinan Hanyu Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinan Hanyu Chemical Co.,Ltd.
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Xiamen PinR Bio-tech Co., Ltd.
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術(shù)有限公司