Cas no 3153-32-0 (tert-butyl 4-chlorobutanoate)

tert-butyl 4-chlorobutanoate structure
tert-butyl 4-chlorobutanoate structure
Product Name:tert-butyl 4-chlorobutanoate
CAS No:3153-32-0
MF:C8H15ClO2
MW:178.656502008438
MDL:MFCD01569943
CID:315691
PubChem ID:527695
Update Time:2025-04-19

tert-butyl 4-chlorobutanoate Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid,4-chloro-, 1,1-dimethylethyl ester
    • 4-CHLOROBUTYRIC ACID TERT-BUTYL ESTER
    • tert-butyl 4-chlorobutanoate
    • 4-chloro-butanoic acid tert-butyl ester
    • 4-chloro-butyric acid tert-butyl ester
    • AC1LB1ZJ
    • AG-F-05179
    • Butanoic acid, 4-chloro, 1,1-dimethylethyl ester
    • CTK4G7300
    • KB-260717
    • t-butyl 4-chloro butanoate
    • tert.-butyl 4-chlorobutanoate
    • tert-butyl 4-chlorobutyrate
    • EN300-128977
    • 3153-32-0
    • tert-butyl4-chlorobutanoate
    • DTXSID20185429
    • D83903
    • AS-77599
    • Butanoic acid, 4-chloro-,1,1-dimethylethyl ester;Butanoic acid, 4-chloro,1,1-dimethylethyl ester
    • SY149264
    • MFCD01569943
    • AKOS014313500
    • t-butyl-4-chlorobutyrate
    • CS-0078972
    • Butanoic acid, 4-chloro-, 1,1-dimethylethyl ester
    • BCP31209
    • t-butyl 4-chlorobutyrate
    • SCHEMBL417782
    • MDL: MFCD01569943
    • Inchi: 1S/C8H15ClO2/c1-8(2,3)11-7(10)5-4-6-9/h4-6H2,1-3H3
    • InChI Key: CRSVVUBCNZULGK-UHFFFAOYSA-N
    • SMILES: ClCCCC(=O)OC(C)(C)C

Computed Properties

  • Exact Mass: 178.07615
  • Monoisotopic Mass: 178.076057
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 5
  • Complexity: 127
  • 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
  • Topological Polar Surface Area: 26.3
  • XLogP3: 2

Experimental Properties

  • Density: 1.017
  • Boiling Point: 206°Cat760mmHg
  • Flash Point: 81.2°C
  • Refractive Index: 1.433
  • PSA: 26.3

tert-butyl 4-chlorobutanoate Pricemore >>

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