Basic information
- CAS
34915-18-9- Standard SMILES
Nc1ccc(-c2ccc(N)c(OCCCC(=O)O)c2)cc1OCCCC(=O)O- InChIKey
NUBOMXHHTQFVBI-UHFFFAOYSA-N- Molecular formula
- C20H24N2O6
- Average molar mass
- 388.4 g/mol
- Monoisotopic mass
- 388.16343649
Overview
safer substitute for benzidine type chromogens; RN given refers to parent cpd; structure
Names & identifiers
- Preferred name
- Dicarboxidine
- IUPAC
- 4-[2-amino-5-[4-amino-3-(3-carboxypropoxy)phenyl]phenoxy]butanoic acid
- English name
- dicarboxidine
- Molecular formula
- C20H24N2O6
- Molecular weight
- 388.41
Names & synonyms
Dicarboxidine34915-18-9DTXSID10188469Butanoic acid, 4,4'-((4,4'-diamino(1,1'-biphenyl)-3,3'-diyl)bis(oxy))bis-alpha, alpha'-(4,4'-diamino-3,3'-biphenylenedioxy)dibutyric acidRefChem:132992DTXCID901109604-[2-amino-5-[4-amino-3-(3-carboxypropoxy)phenyl]phenoxy]butanoic acid4,4'-((4,4'-Diamino-[1,1'-biphenyl]-3,3'-diyl)bis(oxy))dibutyric acidorb1697453SCHEMBL11575722SCHEMBL30118847
Show more names
4-[4,4'-Diamino-3'-(3-carboxy-propoxy)-biphenyl-3-yloxy]-butyric acidButanoic acid, 4,4'-[(4,4'-diamino[1,1'-biphenyl]-3,3'-diyl)bis(oxy)]bis-
SCHEMBL31424232alpha,alpha'-(4,4'-Diamino-3,3'-biphenylenedioxy)dibutyric acidAKOS040751556T314324,4'-[(4,4'-Diamino[1,1'-biphenyl]-3,3'-diyl)bis(oxy)]dibutanoic acid
Database identifiers
- CAS
34915-18-9- PubChem CID
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 459
Physicochemical properties
- Melting point
- 160 °C · >160 °C (decomp)
- Boiling point
- 677.3 · 677.3±55.0 °C(Predicted)
- Density
- 1.314 · 1.314±0.06 g/cm3(Predicted)
- pka
- 4.44 · 4.44±0.10(Predicted)
Chemistry & industry
Suppliers2 total
苏州市晨科生物科技有限公司18662408853 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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