Cas no 2227697-23-4 (rac-(1R,3R)-2,2-dimethyl-3-(1,3-thiazol-5-yl)cyclopropane-1-carboxylic acid)

rac-(1R,3R)-2,2-dimethyl-3-(1,3-thiazol-5-yl)cyclopropane-1-carboxylic acid structure
2227697-23-4 structure
Product Name:rac-(1R,3R)-2,2-dimethyl-3-(1,3-thiazol-5-yl)cyclopropane-1-carboxylic acid
CAS No:2227697-23-4
MF:C9H11NO2S
MW:197.2541410923
CID:5788807
PubChem ID:96240132
Update Time:2023-12-26

rac-(1R,3R)-2,2-dimethyl-3-(1,3-thiazol-5-yl)cyclopropane-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • rac-(1R,3R)-2,2-dimethyl-3-(1,3-thiazol-5-yl)cyclopropane-1-carboxylic acid
    • EN300-1764584
    • 2227697-23-4
    • Inchi: 1S/C9H11NO2S/c1-9(2)6(7(9)8(11)12)5-3-10-4-13-5/h3-4,6-7H,1-2H3,(H,11,12)/t6-,7+/m1/s1
    • InChI Key: YQUWZKNWECMUGY-RQJHMYQMSA-N
    • SMILES: S1C=NC=C1[C@@H]1[C@@H](C(=O)O)C1(C)C

Computed Properties

  • Exact Mass: 197.05104977g/mol
  • Monoisotopic Mass: 197.05104977g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 242
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 78.4?2

rac-(1R,3R)-2,2-dimethyl-3-(1,3-thiazol-5-yl)cyclopropane-1-carboxylic acid Pricemore >>

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