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CAS 27486-90-4 2-Amino-6-(tritylamino)hexanoic acid (HCID 277165)|Huagongshe
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Compound
2-Amino-6-(tritylamino)hexanoic acid
HCID
277165
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
CAS
27486-90-4
Standard SMILES
NC(CCCCNC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O
InChIKey
FBRZWQGBQSPUMV-UHFFFAOYSA-N
Molecular formula
C25H28N2O2
Average molar mass
388.5 g/mol
Monoisotopic mass
388.21507814
Names & identifiers
Preferred name
2-Amino-6-(tritylamino)hexanoic acid
IUPAC
2-amino-6-(tritylamino)hexanoic acid
Names & synonyms
NSC125682
NSC-125682
27486-90-4
Database identifiers
CAS
27486-90-4
PubChem CID
277165
Properties
Computed structural properties
XLogP
1.9
Topological polar surface area
75.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
29
Formal charge
0
Complexity
432
Show all 8
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Related reactions
2 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
155986
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
1569706
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Compound notes
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