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(2S)-2-[[(2R)-2-azaniumyl-4-methylpentanoyl]amino]-4-methylpentanoate

HCID 6992073
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
38689-31-5
Standard SMILES
CC(C)C[C@@H]([NH3+])C(=O)N[C@@H](CC(C)C)C(=O)[O-]
InChIKey
LCPYQJIKPJDLLB-ZJUUUORDSA-N
Molecular formula
C12H24N2O3
Average molar mass
244.33 g/mol
Monoisotopic mass
244.17869263

Overview

See also: D-Leucyl-L-leucine (preferred).

Names & identifiers

Preferred name
(2S)-2-[[(2R)-2-azaniumyl-4-methylpentanoyl]amino]-4-methylpentanoate
IUPAC
(2S)-2-[[(2R)-2-azaniumyl-4-methylpentanoyl]amino]-4-methylpentanoate

Names & synonyms

(2S)-2-[[(2R)-2-azaniumyl-4-methylpentanoyl]amino]-4-methylpentanoate

Database identifiers

CAS
38689-31-5
PubChem CID
6992073

Properties

Computed structural properties

XLogP
-0.8
Topological polar surface area
96.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
17
Formal charge
0
Complexity
259

Related reactions

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Compound notes

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