- InChI
- InChI=1S/C6H14OS2/c1-7-6(4-8-2)5-9-3/h6H,4-5H2,1-3H3
- InChI Key
- MOISORXUYSHXRU-UHFFFAOYSA-N
- Formula
- C6H14OS2
- SMILES
- COC(CSC)CSC
- Molecular Weight1
- 166.31
- CAS
- 31805-84-2
- Other Names
-
- Propane, 2-methoxy-1,3-bis(methylthio)-
- 2-methoxy-1,3-bis(methylthio)propane
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.3783 | Relay (1.0) Calculated Property | |
| ΔfG° | -41.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -217.80 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.50 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.29 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.727 | Crippen Calculated Property | |
| McVol | 133.970 | ml/mol | McGowan Calculated Property |
| Pc | 3195.54 | kPa | Joback Calculated Property |
| Tboil | 478.31 | K | Relay (1.0) Calculated Property |
| Tc | 670.75 | K | Relay (1.0) Calculated Property |
| Tfus | 223.92 | K | Relay (1.0) Calculated Property |
| Vc | 0.441 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [276.90; 343.95] | J/mol×K | [496.22; 711.42] | 
|
| Cp,gas | 276.90 | J/mol×K | 496.22 | Joback Calculated Property |
| Cp,gas | 289.37 | J/mol×K | 532.09 | Joback Calculated Property |
| Cp,gas | 301.34 | J/mol×K | 567.95 | Joback Calculated Property |
| Cp,gas | 312.80 | J/mol×K | 603.82 | Joback Calculated Property |
| Cp,gas | 323.73 | J/mol×K | 639.69 | Joback Calculated Property |
| Cp,gas | 334.12 | J/mol×K | 675.55 | Joback Calculated Property |
| Cp,gas | 343.95 | J/mol×K | 711.42 | Joback Calculated Property |
Similar Compounds
![Bis[(3-chloropropylthio)ethyl] ether.](data:image/png;base64,iVBORw0KGgoAAAANSUhEUgAAAPoAAAD6CAIAAAAHjs1qAAANnklEQVR4nO3bfVBU9R7H8d8Cy4MsCIqEhGgQKYg8pIj5UE5WZDKZM5LZtFMzXZhR79CUf6zOdWZtRufuVH9A19sNwxrGsatmei8OpmmmhWbMLqw8BCwioIuwC7o87fPD7/5xbAd1YYFdszvfz+svWc/+9sc5b875nSOKOOcMgIaARz0BgD8OcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBEOQOhCB3IAS5AyHIHQhB7kAIcgdCkDsQgtyBkMnl3mvvNTgND2kqDxvnzkc9hT+v//edwxlvsbR43SzI6xYWl2V793YHd9i4LXNaZmpIal5knj9m+IfS6/cZjZcDA6Pj4z8MCop51NP5Exka+l6v3xcSMjcm5i9hYZmPejqTc+jOoe+GvhOLxK9Gvnp88PjBeQfH39577gduH1g6benbM98ecY0cNhz20zw9aGtrmz59enBwcFRUlN8HHxysSkr6d2Cg/0cWaDQasVickJAgFov9Pnh3d3doaKjRaExMTPT74IODp2bP/lt4eK7fRxZoNJrIyMjw8PCIiAj/jqx36A8bDlcmV4qYqM/ed3zwuNe3eF/M1JvrV0lWMcYkARIRE3HGt97cqjarfZ+u2507d9577720tLQNGzYkJyeXlpY6nX68tnLG2OzZOzs63tJqt3NuE17xl7a2ttdff33RokVr1qxJT0+vqqry4+A2m620tDQ1NXXjxo0LFizYsWPH8PCwH8dnjMfG/lWn+7iz8x2Ho8+/e+b27dvCYV2/fn1SUpK/DytrtbTmTMsRMRFjLCJwYj9L3Jud3Turh6uFP5f3l2+/uZ2pWGBtYFFXkd6u9/r28QmHMzo6mjEWFBT0xBNPCLPKysq6cOGCj4Nzzo1GZUvLCoPhhPBlT8/fDYYTzc253d1yp9Ps4+AGg+GDDz4QTucRERHx8fHC5PPz81tbW32dOufffPPNvHnzhDGffPJJkUjEGJszZ87XX3/tcrl8HNxqvdHRIb1160Phy4GBqlu39rS3F3R0SO0+H1ar1frJJ59Mnz6dMRYcHOz+LpYsWVJdXe3j4JzzSyOXpB3SelP9lhtbhFfMTvNbHW95faP33NssbXlteScMJ/bp932q//SY4ZhMKwupDWEqFqWOUvQqLC7L1CZ97ty5RYsWCTtizZo19fX1nPPKykp39Pn5+devX5/a4DZbd0fH20qlSKlkLS0re3r26nSfajQv9vWVKZVMqWQNDUkGw7dTG9zpdFZUVDz22GOMsYCAAKlU2tvba7PZSkpKhGMsFouLi4sHBgamNv5vv/2Wl3f3Bik1NfX06dOc85qammeeeUZ4MScn5/Lly1Od/LBWu7O2NlSpZGp1rF7/L52utL19Y19fuUoVpFQytXqGTvcPl8s+tfHPnj27cOFCYZ4vvPBCY2Mj57yystIdfX5+fkdHx9QGv2m7+WbHmyKViKlYeX/5puub9un3HTMcOzNwxj+5c8777f2nB0+rjKpbtlu37bc55xqLJv9aPlMxpmIpjSknB05OatJtbW0FBQXu89bRo0dH/63Vai0pKRGWesHBwcXFxUNDQxMf3OWy6nQldXWRSiVTqcQ3bhQ7HINOp8lkanA4BjjnQ0Pnm5oyhOhbW1ebTOpJTf7ChQtZWVnC5HNzc69cuTL6b3t7e999992AgADG2MbsbP7FF9zpnMToer1GJgsMDGSMzZo16/PPP3c4HKO+NVdFRUVcXBxjTCQSSaXSnp6eyczddefO0fr6RKWSKZWi9vYCq7XL5XKYzU12u45zbja3tLW9IuyZxsb5AwNVkxmct7a2rlu3TtgzTz311MmT91RhNBoVCoVEImGMTZs2TSaTDQ8PT3xwk9Ok6FVEqCOYioXVhcm0siHHkMPlqB6u/n7w+2HncJO5yesgE8p9LFUDVfOb5gvRF54qbGlp8fqWkZERuVweEhLCGAsPD5fL5RaL54tDd3d3UVGR0E18fHxZWZlzAt309f23oSFJOGDXrm2wWNo9buZy2fX6f6rVM5VKplIFdnVtGRnp9zr4zZs3pVKpsKhISEioqKgYa1FRW1v77LPP9uTmcsZ4dja/eNHr4Nxm42VlPCaGM7Z5xYqioqK+vj6PGwr7MDQ01L0PzWbvCzODoaa5eamwZ5qbc0dGroy95X8aGpJ/34frBwc978N732KQyWTBwcGMsaioKIVCYbVaPW45eh8+/vjj4+zD0Y7cPjK3Ya5QWsH1gk5rp9e3eORT7pxzm8tWoiuZWTszZWGKWCwe5yCNXgBM/MxUU1OzfPly98rv0qVLY23Z3Nz88ssv7969XKlkjY0LBgZOeR3c4bij1cpUquBvv10wc+bMcQ6S0WiUy+VhYWHCmUkul5tMpvEHd7lc/PBhnpjIGeMiEd+0iXd1jbn1qVN8/nzOGGeMr13ram72Ovnxr5CjCSeOvLwUlSro6tX4vr4yzr2cOFwum3CFvHgxOi4utri4eHBw0OOWwmGNjY11r+t0Op3Xyf/666/Lli0TJr906dJffvllrC2FE8eq06uYimU3Z18cnsCJY2y+5i7QDegKCwvdl+CysrLRl2A+mW/vQS6X6+jRo8IzOJFIVFBQ0HVvN/39/Vu3bv3902O6usonte40m5vef/8dYW5paWlnzpx58NPnzp3r/vTOzsmcWkwmrlDwiAjOGA8L4zIZv29hptHwgoK7oaek8LGr9eiHH35w3/88//zzV69evfdbM+/Zsyc8PJwxFhoaWlPzsdM5ifWDzXZr//4dwgU2Li7uyy+/vO8C++OPP2Zm3n1Uv3r1arV6EsvCB+9/7jv96XS6wsJC4dPnL5u/X7/f6e2n1Cv/5C6oq6t77rnn7rvB0mq1U7h4PcjjFdxut5eVlcXExAgPdoqKivT6KT5VOHv2bFpamvsGq6mpiXOuVCpXrFghvLh48eKff/55aoNzrZZLpVwk4mFhvL2db9nCt2zhmzfzI0d4aSlnjEskXC7nY6zrxifshFmzZt23EyorK5OSktx3h+3t3tckHqlUqpUrVwrjPP300z/99BPn/MaNG1KpVHhxzpw5FRUVUxvc4+LWjzf99/Fn7gL3uZAxlpmZ6V4A7N6922g0+jj4tWvXXnvtNWHwhIQE9zOcl156SQjUF1ar9aOPPoqMjBRukbOzs4VTy+zZs7/66quJ3Dl4UV3NDxzgR47wzz67+0peHh8a4rt28QksAMbX39+/bdu2oKAgxlh0dLT72UhGRsb58+d9HNzlch06dCghIUG4xGVlZQnnHYlEsnfv3oncOYyvtbU1Pz9fmHBiYqL7X9PWrVvnl0e6bv7PnXNuMpkUCkVERER2draPD548On/+fEZGRmhoaHR09PjL1ino7+8vLi4ODAzMyckRTi1jLVunSC7n7meI27ZxjcaPY7e0tKxdu5YxlpKSMmPGjJKSkvtWlb5wP1pZvHixx1Wlj86dO5eeni6RSCIjIx98sOMXIs79+Q9po2m1WqfTqdfrc3Jy/D64w+FQq9UBAQHp6enCAwH/qquri42NtVgsycnJfh66vJxJJOyNNxhjbMMGdvAgk0j8+wlXrlyJioqKi4t7GL+O0dXVJRKJ9Hr9kiVL/D643W6vr69njGVkZDyMX8d4iLmDZ0Yj27yZvfIK6+xkEgnbtetRT4gQ5P4oOBysqYlFR7OH8CtfMA7kDoTgfzMBIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0KQOxCC3IEQ5A6EIHcgBLkDIcgdCEHuQAhyB0L+B60hgd0k9Q11AAAAAElFTkSuQmCC)
Find more compounds similar to 1,3-Bis-(methylthio)-2-methoxypropane.
Sources
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