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2-[Amino(methyl)amino]-1-phenylpropan-1-ol (HCID 15812)|Huagongshe
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Compound
2-[Amino(methyl)amino]-1-phenylpropan-1-ol
HCID
15812
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Basic information
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Basic information
Standard SMILES
CC(C(O)c1ccccc1)N(C)N
InChIKey
UDOPVWKLUOHIID-UHFFFAOYSA-N
Molecular formula
C10H16N2O
Average molar mass
180.25 g/mol
Monoisotopic mass
180.12626314
Names & identifiers
Preferred name
2-[Amino(methyl)amino]-1-phenylpropan-1-ol
IUPAC
2-[amino(methyl)amino]-1-phenylpropan-1-ol
Names & synonyms
SCHEMBL647926
Database identifiers
PubChem CID
15812
Properties
Computed structural properties
XLogP
1
Topological polar surface area
49.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
146
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Related reactions
1 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
208973
As product
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Compound notes
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