Cas no 52750-20-6 (1H-Indene, 3-(1,1-dimethylethyl)-)

1H-Indene, 3-(1,1-dimethylethyl)- structure
52750-20-6 structure
Product Name:1H-Indene, 3-(1,1-dimethylethyl)-
CAS No:52750-20-6
MF:C13H16
MW:172.266143798828
CID:358940
PubChem ID:11137596
Update Time:2025-04-19

1H-Indene, 3-(1,1-dimethylethyl)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Indene, 3-(1,1-dimethylethyl)-
    • 3-tert-butyl-1H-indene
    • AKOS015905628
    • 3-tert-butyl-1H-inden
    • DTXSID20456525
    • 3-t-butylindene
    • 52750-20-6
    • Inchi: 1S/C13H16/c1-13(2,3)12-9-8-10-6-4-5-7-11(10)12/h4-7,9H,8H2,1-3H3
    • InChI Key: QKTNNHZEFGFOQG-UHFFFAOYSA-N
    • SMILES: C(C)(C)(C)C1=CCC2C=CC=CC1=2

Computed Properties

  • Exact Mass: 172.12528
  • Monoisotopic Mass: 172.125200510g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 217
  • 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: 3.9
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
Recommended suppliers
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
SHOCHEM(SHANGHAI) CO.,lTD
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Xiamen PinR Bio-tech Co., Ltd.
Nanjing jingzhu bio-technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing jingzhu bio-technology Co., Ltd.
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd