Cas no 5842-00-2 (2-(Butylamino)ethanetiol)

2-(Butylamino)ethanetiol structure
2-(Butylamino)ethanetiol structure
Product Name:2-(Butylamino)ethanetiol
CAS No:5842-00-2
MF:C6H15NS
MW:133.255000352859
MDL:MFCD00004888
CID:371572
PubChem ID:24892109
Update Time:2025-04-19

2-(Butylamino)ethanetiol Chemical and Physical Properties

Names and Identifiers

    • Ethanethiol,2-(butylamino)-
    • 2-(BUTYLAMINO)ETHANETHIOL
    • 2-Butylamino-aethanthiol
    • 2-butylaminoethanethiol
    • 2-N-Butylaminoethanethiol
    • EINECS 227-431-9
    • DTXSID10207124
    • 2-(butylamino)ethane-1-thiol
    • FT-0755933
    • NS00033922
    • SCHEMBL342393
    • METHYLZ-BROMO-(DIHYDROFURAN-2-YLIDENE)ACETATE
    • NSC 82296
    • NSC-82296
    • (Butylamino)ethanethiol
    • 2-(Butylamino)ethanethiol, 97%
    • AKOS006223709
    • Ethanethiol, 2-(butylamino)-
    • STR05368
    • BRN 0969195
    • NSC82296
    • 5842-00-2
    • G90001
    • BAET cpd
    • DTXCID10129615
    • 2-(Butylamino)ethanetiol
    • MDL: MFCD00004888
    • Inchi: 1S/C6H15NS/c1-2-3-4-7-5-6-8/h7-8H,2-6H2,1H3
    • InChI Key: OUMFAUYLXGTBCX-UHFFFAOYSA-N
    • SMILES: SCCNCCCC

Computed Properties

  • Exact Mass: 133.09300
  • Monoisotopic Mass: 133.093
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 5
  • Complexity: 39.5
  • 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: 13A^2
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1.3

Experimental Properties

  • Color/Form: Not determined
  • Density: 0.901?g/mL?at 25?°C(lit.)
  • Boiling Point: 112-115?°C/10?mmHg(lit.)
  • Flash Point: Fahrenheit: 163.4 ° f < br / > Celsius: 73 ° C < br / >
  • Refractive Index: n20/D 1.4711(lit.)
  • PSA: 50.83000
  • LogP: 1.69680
  • Solubility: Not determined

2-(Butylamino)ethanetiol Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315-H317-H319-H335
  • Warning Statement: P261-P280-P305+P351+P338
  • Hazardous Material transportation number:UN 3334
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S24/25
  • RTECS:KJ0339000
  • Hazardous Material Identification: Xi
  • Risk Phrases:R36/37/38
  • Safety Term:S24/25
  • Storage Condition:Storage at -4 ℃ (6-12weeks), long storage period at -20 ℃ (1-2years), transport at 0 ℃

2-(Butylamino)ethanetiol Pricemore >>

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