Basic information
- CAS
53924-13-3- Standard SMILES
O=C(O)Cn1cc(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c2ccccc21- InChIKey
QTYWEBZPEFFAAC-UHFFFAOYSA-N- Molecular formula
- C23H17Cl2NO2
- Average molar mass
- 410.3 g/mol
- Monoisotopic mass
- 409.0636342
Names & identifiers
- Preferred name
- 1H-Indole-1-acetic acid, 3-(bis(4-chlorophenyl)methyl)-
- IUPAC
- 2-[3-[bis(4-chlorophenyl)methyl]indol-1-yl]acetic acid
Names & synonyms
4,4'-Dichlorodiphenylmethyl-1-indoleacetic acid1H-INDOLE-1-ACETIC ACID, 3-(BIS(4-CHLOROPHENYL)METHYL)-3-(Bis(4-chlorophenyl)methyl)-1H-indole-1-acetic acid53924-13-3DTXSID30202212RefChem:238871DTXCID30124703{3-[bis(4-chlorophenyl)methyl]-1H-indol-1-yl}acetic acid
Database identifiers
- CAS
53924-13-3- PubChem CID
- 40932
- DTXSID
DTXSID30202212
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 507
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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