Thiourea, N,N''-(2,3-dihydroxy-1,4-butanediyl)bis(N'-2-propenyl-
Basic information
- CAS
111915-66-3- Standard SMILES
C=CCNC(=S)NCC(O)C(O)CNC(=S)NCC=C- InChIKey
FJWJXBTYTGERGM-UHFFFAOYSA-N- Molecular formula
- C12H22N4O2S2
- Average molar mass
- 318.5 g/mol
- Monoisotopic mass
- 318.1184183
Names & identifiers
- Preferred name
- Thiourea, N,N''-(2,3-dihydroxy-1,4-butanediyl)bis(N'-2-propenyl-
- IUPAC
- 1-[2,3-dihydroxy-4-(prop-2-enylcarbamothioylamino)butyl]-3-prop-2-enylthiourea
Names & synonyms
111915-66-3Thiourea, N,N''-(2,3-dihydroxy-1,4-butanediyl)bis(N'-2-propenyl-RefChem:1100052BRN 5560509N,N'-Bis(allylthiocarbamoyl)-1,4-diaminobutane-2,3-diolN,N''-(2,3-Dihydroxy-1,4-butanediyl)bis(N'-2-propenylthiourea)DTXSID20920610N,N''-(2,3-Dihydroxybutane-1,4-diyl)bis(N'-prop-2-en-1-ylcarbamimidothioic acid)N,N''-(2,3-Dihydroxybutane-1,4-diyl)bis[N'-(prop-2-en-1-yl)carbamimidothioic acid]
Database identifiers
- CAS
111915-66-3- PubChem CID
- 3086765
- DTXSID
DTXSID20920610
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 307
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Compound notes
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