1-(2-Ethoxyethyl)-3-phenylthiourea

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Basic information

CAS: 55409-90-0
Standard SMILES: CCOCCNC(=S)Nc1ccccc1
InChIKey: DCOVEDKIRIJGLX-UHFFFAOYSA-N
Molecular formula: C11H16N2OS
Average molar mass: 224.32 g/mol
Monoisotopic mass: 224.09833431

Names & identifiers

Preferred name: 1-(2-Ethoxyethyl)-3-phenylthiourea
IUPAC: 1-(2-ethoxyethyl)-3-phenylthiourea

Names & synonyms

1-(2-ethoxyethyl)-3-phenylthiourea55409-90-0Thiourea, N-(2-ethoxyethyl)-N'-phenyl-N-(2-ethoxyethyl)-N'-phenylthioureaDTXSID90367139AKOS000340915SR-01000298924SR-01000298924-1

Database identifiers

CAS: 55409-90-0
PubChem CID: 2236772
DTXSID: DTXSID90367139

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 65.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 5
Heavy atoms: 15
Formal charge: 0
Complexity: 181

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