Cas no 884512-77-0 ((2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid)

(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid structure
884512-77-0 structure
Product Name:(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid
CAS No:884512-77-0
MF:C10H17NO5
MW:231.245683431625
MDL:MFCD09260604
CID:69286
PubChem ID:6559076
Update Time:2024-10-26

(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • (R)-4-(tert-Butoxycarbonyl)morpholine-2-carboxylic acid
    • (2R)-2,4-Morpholinedicarboxylic acid 4-(1,1-dimethylethyl) ester
    • (2R)-4-(1,1-Dimethylethyl) Ester 2,4-Morpholinedicarboxylic Acid
    • (R)-N-BOC-2-MORPHOLINECARBOXYLIC ACID
    • (R)-N-Boc-morpholine-2-carboxylic acid
    • (-)-(2R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylic acid
    • (2R)-4-(tert-butoxycarbonyl)morpholin-2-carboxylic acid
    • (R)-4-BOC-MORPHOLINE-2-CARBOXYLIC ACID
    • (R)-4-tert-butoxycarbonylmorpholine-2-carboxylic acid
    • (R)-Morpholine-2,4-dicarboxylic acid 4-tert-butyl ester
    • 4-{[(1,1-dimethylethyl)oxy]carbonyl}-2-morpholinecarboxylic acid
    • (R)-4-(tert-Butoxycarbonyl)morpholine-2-carboxylicacid
    • (2R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylic acid
    • (2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid
    • (R)-N-Boc-2-morpholinecarboxylicacid
    • L
    • 4-(1,1-Dimethylethyl) (2R)-2,4-morpholinedicarboxylate (ACI)
    • (2R)-4-[(2-Methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylic acid
    • (R)-2-Carboxymorpholine-4-carboxylic acid tert-butyl ester
    • (R)-4-tert-butyloxycarbonyl-2-morpholinecarboxylic acid
    • CS-W006824
    • (2R)-2,4-Morpholinedicarboxylic Acid-4-(1,1-Dimethylethyl)ester
    • (2R)-4-(tert-Butoxycarbonyl)morpholine-2-carboxylic Acid; (R)-4-(tert-Butoxycarbonyl)morpholine-2-carboxylic Acid; (R)-4-(tert-Butoxycarbonyl)morpholine-2-carboxylic Acid
    • AKOS015901309
    • AC-25492
    • MFCD09260604
    • DS-11995
    • EN300-157765
    • Z1263738221
    • 884512-77-0
    • SCHEMBL194709
    • DTXSID80424927
    • (2r)-(tert-butoxycarbonyl)morpholin-2-carboxylic acid
    • LGWMTRPJZFEWCX-SSDOTTSWSA-N
    • MDL： MFCD09260604
    • Inchi： 1S/C10H17NO5/c1-10(2,3)16-9(14)11-4-5-15-7(6-11)8(12)13/h7H,4-6H2,1-3H3,(H,12,13)/t7-/m1/s1
    • InChI Key： LGWMTRPJZFEWCX-SSDOTTSWSA-N
    • SMILES： C(N1CCO[C@@H](C(=O)O)C1)(=O)OC(C)(C)C

Computed Properties

  • Exact Mass: 231.11100
  • Monoisotopic Mass: 231.11067264g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 283
  • 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
  • Topological Polar Surface Area: 76.1
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 0.4

Experimental Properties

  • Color/Form: White to Yellow Solid
  • Density: 1.230
  • Melting Point: No data available
  • Boiling Point: 369.5°C at 760 mmHg
  • Flash Point: 177.3±27.9 °C
  • Refractive Index: 1.492
  • PSA: 76.07000
  • LogP: 0.64480

(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid Security Information

(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid Customs Data

  • HS CODE：2934999090
  • Customs Data：

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid Pricemore >>

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(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Trichloroisocyanuric acid ,  Sodium bicarbonate ,  Tempo ,  Sodium bromide Solvents: Acetone
Reference
Biphenyl/diphenyl ether renin inhibitors: Filling the S1 pocket of renin via the S3 pocket
Yuan, Jing; et al, Bioorganic & Medicinal Chemistry Letters, 2011, 21(16), 4836-4843

Production Method 2

Reaction Conditions
1.1 Reagents: Sodium bicarbonate Solvents: Tetrahydrofuran ,  Water ;  overnight, 25 °C
1.2 Reagents: Hydrochloric acid Solvents: Water ;  pH 2, 25 °C
Reference
Design, synthesis and biological evaluation of protease inhibitors containing morpholine cores with remarkable potency against both HIV-1 subtypes B and C
Zhu, Mei; et al, European Journal of Medicinal Chemistry, 2022, 233,

Production Method 3

Reaction Conditions
1.1 Catalysts: Triacylglycerol lipase Solvents: tert-Butyl methyl ether ,  Water ;  24 - 30 h, rt
2.1 Reagents: 1-Methyl-1,4-cyclohexadiene Catalysts: Palladium Solvents: Ethanol ;  reflux
Reference
Enantioselective synthesis of (R)- and (S)-N-Boc-morpholine-2-carboxylic acids by enzyme-catalyzed kinetic resolution: application to the synthesis of reboxetine analogs
Fish, Paul V.; et al, Tetrahedron Letters, 2009, 50(4), 389-391

Production Method 4

Reaction Conditions
1.1 Reagents: 1-Methyl-1,4-cyclohexadiene Catalysts: Palladium Solvents: Ethanol ;  reflux
Reference
Enantioselective synthesis of (R)- and (S)-N-Boc-morpholine-2-carboxylic acids by enzyme-catalyzed kinetic resolution: application to the synthesis of reboxetine analogs
Fish, Paul V.; et al, Tetrahedron Letters, 2009, 50(4), 389-391

Production Method 5

Reaction Conditions
1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol ;  rt
2.1 Reagents: Trichloroisocyanuric acid ,  Sodium bicarbonate ,  Tempo ,  Sodium bromide Solvents: Acetone
Reference
Biphenyl/diphenyl ether renin inhibitors: Filling the S1 pocket of renin via the S3 pocket
Yuan, Jing; et al, Bioorganic & Medicinal Chemistry Letters, 2011, 21(16), 4836-4843

Production Method 6

Reaction Conditions
1.1 Reagents: Sulfuric acid Solvents: 1-Butanol ,  Water ;  reflux
2.1 Catalysts: Triacylglycerol lipase Solvents: tert-Butyl methyl ether ,  Water ;  24 - 30 h, rt
3.1 Reagents: 1-Methyl-1,4-cyclohexadiene Catalysts: Palladium Solvents: Ethanol ;  reflux
Reference
Enantioselective synthesis of (R)- and (S)-N-Boc-morpholine-2-carboxylic acids by enzyme-catalyzed kinetic resolution: application to the synthesis of reboxetine analogs
Fish, Paul V.; et al, Tetrahedron Letters, 2009, 50(4), 389-391

Production Method 7

Reaction Conditions
1.1 Reagents: Potassium carbonate Solvents: Acetone ,  Water ;  30 min, 0 °C → rt
2.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol ;  rt
3.1 Reagents: Trichloroisocyanuric acid ,  Sodium bicarbonate ,  Tempo ,  Sodium bromide Solvents: Acetone
Reference
Biphenyl/diphenyl ether renin inhibitors: Filling the S1 pocket of renin via the S3 pocket
Yuan, Jing; et al, Bioorganic & Medicinal Chemistry Letters, 2011, 21(16), 4836-4843

Production Method 8

Reaction Conditions
1.1 Reagents: Sodium hydroxide Solvents: Methanol ,  Water ;  2 h, 40 °C
1.2 Reagents: Sodium hydroxide Solvents: Toluene ,  Water ;  16 h, 65 °C
2.1 Reagents: Potassium carbonate Solvents: Acetone ,  Water ;  30 min, 0 °C → rt
3.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol ;  rt
4.1 Reagents: Trichloroisocyanuric acid ,  Sodium bicarbonate ,  Tempo ,  Sodium bromide Solvents: Acetone
Reference
Biphenyl/diphenyl ether renin inhibitors: Filling the S1 pocket of renin via the S3 pocket
Yuan, Jing; et al, Bioorganic & Medicinal Chemistry Letters, 2011, 21(16), 4836-4843

(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid Raw materials

(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid Preparation Products

(2R)-4-[(tert-butoxy)carbonyl]morpholine-2-carboxylic acid Related Literature

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