Cas no 100134-82-5 (benzyl N-(1-cyano-1-methylethyl)carbamate)

benzyl N-(1-cyano-1-methylethyl)carbamate structure
100134-82-5 structure
Product Name:benzyl N-(1-cyano-1-methylethyl)carbamate
CAS No:100134-82-5
MF:C12H14N2O2
MW:218.251762866974
MDL:MFCD10698635
CID:62123
PubChem ID:18442523
Update Time:2025-04-18

benzyl N-(1-cyano-1-methylethyl)carbamate Chemical and Physical Properties

Names and Identifiers

    • Benzyl (1-cyano-1-methylethyl)carbamate
    • Benzyl [1-Cyano-1-methylethyl]carbamate
    • Benzyl [1-Cyano-1-methylethyl]carbamate
    • Benzyl N-(1-cyano-1-methylethyl)carbamate
    • benzyl N-(2-cyanopropan-2-yl)carbamate
    • Raltegravir I
    • Raltegravir Intermediate 1
    • Benzyl (1-cyano-1-methylethyl)
    • benzyl 2-cyanopropan-2-ylcarbaMate
    • N-(1-cyano-1-methylethyl)-, phenylmethyl ester
    • NE-0200
    • J-000052
    • AM85435
    • PB34539
    • FT-0662720
    • Benzyl[1-cyano-1-methylethyl]carbamate
    • A800053
    • (cyano-dimethyl-methyl)carbamic acid benzyl ester
    • DTXSID80593804
    • 2-(Cbz-amino)-2-methylpropanenitrile
    • BENZYL (2-CYANOPROPAN-2-YL)CARBAMATE
    • Benzyl 1-cyano-1-methylethylcarbamate
    • SCHEMBL1150695
    • Carbamic acid, (1-cyano-1-methylethyl)-, phenylmethyl ester
    • AKOS015836095
    • DJQKBMUYZUEUBU-UHFFFAOYSA-N
    • EN300-4410543
    • 100134-82-5
    • J-519765
    • benzyl N-(1-cyano-1-methyl-ethyl)carbamate
    • Carbamic acid, N-(1-cyano-1-methylethyl)-, phenylmethyl ester
    • MFCD10698635
    • SY326399
    • Benzyl(1-cyano-1-methylethyl)carbamate
    • 7VTU9TZ2E6
    • DB-022605
    • Phenylmethyl N-(1-cyano-1-methylethyl)carbamate
    • benzyl N-(1-cyano-1-methylethyl)carbamate
    • MDL: MFCD10698635
    • Inchi: 1S/C12H14N2O2/c1-12(2,9-13)14-11(15)16-8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,14,15)
    • InChI Key: DJQKBMUYZUEUBU-UHFFFAOYSA-N
    • SMILES: O(C(NC(C#N)(C)C)=O)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 218.10600
  • Monoisotopic Mass: 218.105527694g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 285
  • 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
  • XLogP3: 1.8
  • Topological Polar Surface Area: 62.1?2

Experimental Properties

  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 381.6±35.0 °C at 760 mmHg
  • Flash Point: 184.6±25.9 °C
  • PSA: 62.12000
  • LogP: 2.60588
  • Vapor Pressure: 0.0±0.9 mmHg at 25°C

benzyl N-(1-cyano-1-methylethyl)carbamate Security Information

benzyl N-(1-cyano-1-methylethyl)carbamate Customs Data

  • HS CODE:2926909090
  • Customs Data:

    China Customs Code:

    2926909090

    Overview:

    2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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benzyl N-(1-cyano-1-methylethyl)carbamate Production Method

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