L-Aspartic acid-1-13C

Base Information

• Chemical Name: L-Aspartic acid-1-13C
• CAS No.: 81201-97-0
• Molecular Formula: C4H7 N O4
• Molecular Weight: 134.11
• European Community (EC) Number: 693-119-8
• DSSTox Substance ID: DTXSID80583962
• Wikidata: Q82475582
• Mol file: 81201-97-0.mol

Synonyms:L-Aspartic acid-1-13C;81201-97-0;L-Aspartic acid 13C;(2S)-2-amino(113C)butanedioic acid;L-Aspartic acid-13C;L-Aspartic acid(1-13c);L-(1-~13~C)Aspartic acid;HY-N0666S;DTXSID80583962;AKOS040758360;MS-22787;CS-0226241;L-Aspartic acid-1-13C, 99 atom % 13C;G12317

Chemical Property of L-Aspartic acid-1-13C

Chemical Property:

• Melting Point: >300 °C (dec.)(lit.)
• PSA: 100.62000
• LogP: -0.42670
• XLogP3: -2.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 134.04086254
• Heavy Atom Count: 9
• Complexity: 133

Purity/Quality:

98%,99%, ^*data from raw suppliers

L-Aspartic acid-1-13C 99 atom % 13C ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 40
• Safety Statements: 22-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(=O)O)N)C(=O)O
• Isomeric SMILES: C([C@@H]([13C](=O)O)N)C(=O)O

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