Cas no 24621-61-2 ((S)-(+)-1,3-Butanediol)

(S)-(+)-1,3-Butanediol structure
(S)-(+)-1,3-Butanediol structure
Product Name:(S)-(+)-1,3-Butanediol
CAS No:24621-61-2
MF:C4H10O2
MW:90.1210017204285
MDL:MFCD00064278
CID:269972
PubChem ID:24854258
Update Time:2025-04-19

(S)-(+)-1,3-Butanediol Chemical and Physical Properties

Names and Identifiers

    • (S)-Butane-1,3-diol
    • (S)-(+)-1,3-Butanediol
    • 1,3-Butanediol,(3S)-
    • (3S)-butane-1,3-diol
    • (S)-(+)-1,3-Butylene Glycol
    • (S)-(+)-1,3-Dihydroxybutane
    • BU2
    • (S)-1,3-butanediol
    • (S)-(+)-Butane-1,3-diol
    • 1,3-Butanediol, (3S)-
    • PUPZLCDOIYMWBV-BYPYZUCNSA-N
    • 1,3-Butanediol, (S)-
    • S-(+)-1,3-Butanediol
    • PubChem6722
    • D-Butane-1,3-diol
    • (+)-1,3-butanediol
    • MDL: MFCD00064278
    • Inchi: 1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3/t4-/m0/s1
    • InChI Key: PUPZLCDOIYMWBV-BYPYZUCNSA-N
    • SMILES: O[C@@H](C)CCO

Computed Properties

  • Exact Mass: 90.06810
  • Monoisotopic Mass: 90.068
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 6
  • Rotatable Bond Count: 2
  • Complexity: 28.7
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: -0.4
  • Topological Polar Surface Area: 40.5

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.005
  • Melting Point: 0.07°C (estimate)
  • Boiling Point: 109°C/14mmHg(lit.)
  • Flash Point: 121 oC
  • Refractive Index: 1.440
  • Stability/Shelf Life: hygroscopic
  • PSA: 40.46000
  • LogP: -0.25040
  • Vapor Pressure: 0.06 mm Hg ( 20 °C)
  • Specific Rotation: +27 - +33 °(c=1,EtOH)
  • Solubility: Not determined

(S)-(+)-1,3-Butanediol Security Information

(S)-(+)-1,3-Butanediol Customs Data

  • HS CODE:2905399090
  • Customs Data:

    China Customs Code:

    2905399090

    Overview:

    2905399090 Other diols.Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods).VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, packing

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food
    M.Import commodity inspection
    N.Export commodity inspection

    Summary:

    2905399090 other diols.supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward).VAT:17.0%.tax rebate rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

(S)-(+)-1,3-Butanediol Pricemore >>

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(S)-(+)-1,3-Butanediol Production Method

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