Cas no 141595-98-4 (D-Tryptophan,phenylmethyl ester)

D-Tryptophan,phenylmethyl ester structure
141595-98-4 structure
Product Name:D-Tryptophan,phenylmethyl ester
CAS No:141595-98-4
MF:C18H18N2O2
MW:294.347724437714
CID:101486
PubChem ID:24877854
Update Time:2025-04-18

D-Tryptophan,phenylmethyl ester Chemical and Physical Properties

Names and Identifiers

    • D-Tryptophan,phenylmethyl ester
    • benzyl (2R)-2-amino-3-(1H-indol-3-yl)propanoate
    • D-TRYPTOPHAN BENZYL ESTER
    • benzyl D-tryptophanate
    • MFCD02683456
    • SCHEMBL8025702
    • D-Tryptophan benzyl ester, 98%
    • CS-0201859
    • CHEMBL188529
    • 141595-98-4
    • BDBM50154574
    • (R)-Benzyl 2-amino-3-(1H-indol-3-yl)propanoate
    • D-TRYPTOPHAN BENZYL ESTER 98
    • H-DTrp-OBzl
    • DTXSID60426409
    • 2-Amino-3-(1H-indol-3-yl)-propionic acid benzyl ester
    • TYQYRKDGHAPZRF-MRXNPFEDSA-N
    • D-Tryptophan, phenylmethyl ester
    • J-007521
    • G78544
    • MDL: MFCD02683456
    • Inchi: 1S/C18H18N2O2/c19-16(18(21)22-12-13-6-2-1-3-7-13)10-14-11-20-17-9-5-4-8-15(14)17/h1-9,11,16,20H,10,12,19H2/t16-/m1/s1
    • InChI Key: TYQYRKDGHAPZRF-MRXNPFEDSA-N
    • SMILES: O(CC1C=CC=CC=1)C([C@@H](CC1=CNC2C=CC=CC1=2)N)=O

Computed Properties

  • Exact Mass: 294.136827821g/mol
  • Monoisotopic Mass: 294.136827821g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 6
  • Complexity: 368
  • 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
  • XLogP3: 3
  • Topological Polar Surface Area: 68.1?2

Experimental Properties

  • Density: 1.247
  • Melting Point: 77-80?°C (lit.)
  • Boiling Point: 489.9°C at 760 mmHg
  • Flash Point: 250.1°C
  • Refractive Index: 1.659
  • PSA: 68.11000
  • LogP: 3.48140
  • Optical Activity: [α]20/D ?9.9°, c =?1 in ethanol

D-Tryptophan,phenylmethyl ester Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3

D-Tryptophan,phenylmethyl ester Pricemore >>

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