Glutaranilic acid, 3'-amino-4',6'-diiodo-N-methyl-
Basic information
- CAS
38622-28-5- Standard SMILES
CN(C(=O)CCCC(=O)O)c1ccc(I)c(N)c1I- InChIKey
UMGRBMJCHMPETN-UHFFFAOYSA-N- Molecular formula
- C12H14I2N2O3
- Average molar mass
- 488.06 g/mol
- Monoisotopic mass
- 487.90939
Names & identifiers
- Preferred name
- Glutaranilic acid, 3'-amino-4',6'-diiodo-N-methyl-
- IUPAC
- 5-(3-amino-2,4-diiodo-N-methylanilino)-5-oxopentanoic acid
Names & synonyms
3'-Amino-4',6'-diiodo-N-methyl-glutaranilic acidGlutaranilic acid, 3'-amino-4',6'-diiodo-N-methyl-38622-28-5DTXSID80191940Pentanoic acid, 5-((3-amino-2,4-diiodophenyl)methylamino)-5-oxo-RefChem:346168DTXCID20114431Pentanoic acid, 5-((3-amino-2,4-diiodophenyl)methylamino)-5-oxo-(9CI)5-[(3-amino-2,4-diiodophenyl)(methyl)amino]-5-oxopentanoic acid
Database identifiers
- CAS
38622-28-5- PubChem CID
- 217339
- DTXSID
DTXSID80191940
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 341
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Compound notes
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