Basic information
- CAS
81530-23-6- Standard SMILES
CC(C)(N)Cc1ccc(N)c(I)c1- InChIKey
SJTPTIAXCKYNNF-UHFFFAOYSA-N- Molecular formula
- C10H15IN2
- Average molar mass
- 290.14 g/mol
- Monoisotopic mass
- 290.028
Overview
labeled with (125)I as brain imaging agent; RN given refers to parent cpd; structure given in first source
Names & identifiers
- Preferred name
- 3-Iodo-4-aminophentermine
- IUPAC
- 4-(2-amino-2-methylpropyl)-2-iodoaniline
- English name
- 3-iodo-4-aminophentermine
- Molecular formula
- C10H15IN2
- Molecular weight
- 290.14397
Names & synonyms
3-Iodo-4-aminophentermine3-Iamp81530-23-6DTXSID50231185RefChem:94434DTXCID501536764-(2-amino-2-methylpropyl)-2-iodoaniline4-Amino-3-iodo-alpha,alpha-dimethylbenzeneethanamineBenzeneethanamine, 4-amino-3-iodo-alpha,alpha-dimethyl-
Database identifiers
- CAS
81530-23-6- PubChem CID
- 133705
- DTXSID
DTXSID50231185
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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