Completing data — usually done within a minute
Basic information
- CAS
104186-69-8- Standard SMILES
O=C(O)CNC(=O)CNC(=O)CNC(=O)CCl- InChIKey
JDIFMCNVLPJSTJ-UHFFFAOYSA-N- Molecular formula
- C8H12ClN3O5
- Average molar mass
- 265.65 g/mol
- Monoisotopic mass
- 265.04654816
Names & identifiers
- Preferred name
- N-(Chloroacetyl)glycylglycylglycine
- IUPAC
- 2-[[2-[[2-[(2-chloroacetyl)amino]acetyl]amino]acetyl]amino]acetic acid
Names & synonyms
104186-69-8N-(Chloroacetyl)glycylglycylglycinechloroacetylglycylglycylglycineSCHEMBL4786380DTXSID50563377JDIFMCNVLPJSTJ-UHFFFAOYSA-N
Database identifiers
- CAS
104186-69-8- PubChem CID
- 14723669
- DTXSID
DTXSID50563377
Properties
Computed structural propertiesFilling in
- XLogP
- -1.6
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 320
Related reactions
7 records
Compound notes
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