Cas no 10123-62-3 (Diethyl (2-cyanoethyl)phosphonate)

Diethyl (2-cyanoethyl)phosphonate structure
10123-62-3 structure
Product Name:Diethyl (2-cyanoethyl)phosphonate
CAS No:10123-62-3
MF:C7H14NO3P
MW:191.164722919464
MDL:MFCD00013825
CID:149054
PubChem ID:82369
Update Time:2025-04-19

Diethyl (2-cyanoethyl)phosphonate Chemical and Physical Properties

Names and Identifiers

    • Phosphonic acid,P-(2-cyanoethyl)-, diethyl ester
    • DIETHYL (2-CYANOETHYL)-PHOSPHONATE
    • 2-Cyanoethanephosphonic acid diethyl ester
    • Diethyl (2-cyanoethyl)phosphonate
    • Diethyl 2-cyanoethanephosphonate
    • EINECS 233-327-4
    • 3-(Diethylphosphono)propionitrile
    • NSC 43781
    • NSC 74863
    • Ai3-16155
    • Brn 1775584
    • 3-Diethoxyphosphorylpropanenitrile
    • 3-(Diethoxyphosphinyl)propiononitrile
    • DIETHYL (2-CYANOETHYL)PHOSPHONATE 95
    • LDOZIDLMPNCNDI-UHFFFAOYSA-N
    • EN300-1722908
    • WLN: NC2PO&O2&O2
    • diethyl(2-cyanoethyl)phosphonate
    • AS-68304
    • NCIOpen2_000815
    • NSC-43781
    • 4-04-00-03620 (Beilstein Handbook Reference)
    • NS00023038
    • NSC74863
    • beta-(Diethoxyphosphinyl)propionitrile
    • (2-Cyanoethyl)-phosphonic acid diethyl ester
    • DTXSID80143803
    • SCHEMBL491513
    • Ethanephosphonic acid, 2-cyano-, diethyl ester
    • NSC43781
    • .beta.-(Diethoxyphosphinyl)propionitrile
    • diethyl 2-cyanoethylphosphonate
    • Phosphonic acid, P-(2-cyanoethyl)-, diethyl ester
    • 10123-62-3
    • O,O-diethyl (2-cyanoethyl)phosphonate
    • CS-0362849
    • (2-Cyano-ethyl)-phosphonic acid diethyl ester
    • diethyl cyanoethylphosphonate
    • AKOS015916240
    • Phosphonic acid, (2-cyanoethyl)-, diethyl ester
    • J-000347
    • Diethyl (2-cyanoethyl)phosphonate, 95%
    • NSC-74863
    • STL512128
    • G64498
    • BBL100161
    • 3-(Diethyl phosphono)propionitrile; (2-Cyanoethyl)phosphonic acid diethyl esterDiethyl (2-cyanoethyl)phosphonate; O,O'-Diethyl (2-cyanoethyl)phosphonatebeta-(Diethoxyphosphinyl)propionitrile;
    • DTXCID0066294
    • MDL： MFCD00013825
    • Inchi： 1S/C7H14NO3P/c1-3-10-12(9,11-4-2)7-5-6-8/h3-5,7H2,1-2H3
    • InChI Key： LDOZIDLMPNCNDI-UHFFFAOYSA-N
    • SMILES： P(CCC#N)(=O)(OCC)OCC

Computed Properties

  • Exact Mass: 207.06600
  • Monoisotopic Mass: 191.07113031g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 6
  • Complexity: 198
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: -0.1
  • Topological Polar Surface Area: 59.3?2

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.08?g/mL?at 25?°C(lit.)
  • Boiling Point: 110?°C/0.1?mmHg(lit.)
  • Flash Point: >230?°F
  • Refractive Index: n20/D 1.4380(lit.)
  • PSA: 78.36000
  • LogP: 2.09778
  • Solubility: Not determined

Diethyl (2-cyanoethyl)phosphonate Security Information

  • Symbol: GHS07
  • Signal Word：Warning
  • Hazard Statement： H315-H319-H335
  • Warning Statement： P261-P305+P351+P338
  • Hazardous Material transportation number：NONH for all modes of transport
  • WGK Germany：3
  • Hazard Category Code： 36/37/38
  • Safety Instruction： 26-36
  • RTECS：KI6650000
  • Hazardous Material Identification： Xi
  • Risk Phrases：R36/37/38

Diethyl (2-cyanoethyl)phosphonate Customs Data

  • HS CODE：2931900090
  • Customs Data：

    China Customs Code:

    2931900090

    Overview:

    2931900090. Other organic-Inorganic compound. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods). MFN tariff:6.5%. general tariff:30.0%

    Summary:

    2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%

Diethyl (2-cyanoethyl)phosphonate Pricemore >>

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