Basic information
- CAS
19094-52-1- Standard SMILES
CC(=O)Nc1c(I)cc(I)cc1C(=O)O- InChIKey
RXUZIZREGNCEBC-UHFFFAOYSA-N- Molecular formula
- C9H7I2NO3
- Average molar mass
- 430.97 g/mol
- Monoisotopic mass
- 430.85154
Names & identifiers
- Preferred name
- 2-(Acetylamino)-3,5-diiodobenzoic acid
- IUPAC
- 2-acetamido-3,5-diiodobenzoic acid
- English name
- 2-Acetylamino-3,5-diiodobenzoic acid
- Molecular formula
- C9H7I2NO3
- Molecular weight
- 0
Names & synonyms
19094-52-1ANTHRANILIC ACID, N-ACETYL-3,5-DIIODO-2-(acetylamino)-3,5-diiodobenzoic acidDTXSID90172604RefChem:1061410DTXCID00950952-acetamido-3,5-diiodobenzoic acid2-Acetylamino-3,5-diiodobenzoic acidBRN 3312862N-Acetyl-3,5-diiodoanthranilic acidAP-213/40650832
Database identifiers
- CAS
19094-52-1- PubChem CID
- 29423
- DTXSID
DTXSID90172604- Nikkaji
- J60.456I
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 272
Chemistry & industry
Suppliers1 total
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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