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N-Carbamyltryptophan
[CAS# 54896-75-2]

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Identification
Name N-Carbamyltryptophan
Synonyms 3-(1H-Indol-3-Yl)-2-Ureido-Propanoic Acid; 3-(1H-Indol-3-Yl)-2-Ureidopropanoic Acid; 3-(1H-Indol-3-Yl)-2-Ureido-Propionic Acid
Molecular Structure CAS#: 54896-75-2, N-Carbamyltryptophan
Molecular Formula C12H13N3O3
Molecular Weight 247.25
CAS Registry Number 54896-75-2
SMILES C1=CC=CC2=C1C(=C[NH]2)CC(NC(N)=O)C(O)=O
InChI 1S/C12H13N3O3/c13-12(18)15-10(11(16)17)5-7-6-14-9-4-2-1-3-8(7)9/h1-4,6,10,14H,5H2,(H,16,17)(H3,13,15,18)
InChIKey NWLXJVDJMARXSP-UHFFFAOYSA-N
Properties
Density 1.435g/cm3 (Cal.)
Boiling point 538.393°C at 760 mmHg (Cal.)
Flash point 279.41°C (Cal.)
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