Basic information
- Standard SMILES
CCOc1ccccc1NC(=S)Nc1ccccc1OCC- InChIKey
JNYGERXLRVWVMQ-UHFFFAOYSA-N- Molecular formula
- C17H20N2O2S
- Average molar mass
- 316.4 g/mol
- Monoisotopic mass
- 316.12454888
Names & identifiers
- Preferred name
- Carbanilide, 2,2'-diethoxythio-
- IUPAC
- 1,3-bis(2-ethoxyphenyl)thiourea
- English name
- Aethoxidum
- Molecular formula
- C17H20N2O2S
- Molecular weight
- 316.42
Names & synonyms
1756-44-1Thiourea, N,N'-bis(2-ethoxyphenyl)-Carbanilide, 2,2'-diethoxythio-2,2'-DiethoxythiocarbanilideBRN 2818778DTXSID901700042-13-00-00179 (Beilstein Handbook Reference)RefChem:333195DTXCID60924951,3-bis(2-ethoxyphenyl)thioureaAethoxidumOprea1_152437
Show more names
Ethocarlide2,2'-diethoxythio-carbanilidn,n'-bis(2-ethoxyphenyl)-thioure
SCHEMBL10393407N,N'-Bis(2-ethoxyphenyl)thioureaAKOS002272108bis[(2-ethoxyphenyl)amino]methane-1-thioneST50159688
Database identifiers
- CAS
1756-44-1- PubChem CID
- 3035276
- DTXSID
DTXSID90170004
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 311
Physicochemical properties
- Melting point
- 125 °C · 125 °C(Solv: methanol (67-56-1))
- Boiling point
- 441.2 · 441.2±55.0 °C(Predicted)
- Density
- 1.222 · 1.222±0.06 g/cm3(Predicted)
- pka
- 12.18 · 12.18±0.70(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
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Related reactions
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Linked notes
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