Arginine chloromethyl ketone
Basic information
- CAS
76833-33-5- Standard SMILES
NC(N)=NCCCC(N)C(=O)CCl- InChIKey
VNDNKFJKUBLYQB-UHFFFAOYSA-N- Molecular formula
- C7H15ClN4O
- Average molar mass
- 206.67 g/mol
- Monoisotopic mass
- 206.0934388
Names & identifiers
- Preferred name
- Arginine chloromethyl ketone
- IUPAC
- 2-(4-amino-6-chloro-5-oxohexyl)guanidine
- English name
- arginine chloromethyl ketone
- Molecular formula
- C7H15ClN4O
- Molecular weight
- 206.67
Names & synonyms
Arginine chloromethyl ketoneArg-chloromethyl ketone76833-33-5Guanidine, (4-amino-6-chloro-5-oxohexyl)-RefChem:113913SCHEMBL2186462DTXSID30998148N-(4-Amino-6-chloro-5-oxohexyl)guanidineGuanidine, N-(4-amino-6-chloro-5-oxohexyl)-
Database identifiers
- CAS
76833-33-5- PubChem CID
- 196479
- DTXSID
DTXSID30998148
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 191
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