|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
567
Total Number of Articles : 709
|
| PubChem |
1140
|
| Molecular Formula |
C7H8 |
| SMILES |
CC1=CC=CC=C1 |
| InChI |
InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 |
| synonyms |
- toluene
- methylbenzene
- 108-88-3
- toluol
- Phenylmethane
- methacide
- methylbenzol
- antisal 1a
- Toluen
- tolu-sol
- Methane, phenyl-
- Tolueen
- Toluolo
- phenyl methane
- 1-Methylbenzene
- RCRA waste number U220
- Tolueno
- Caswell No. 859
- NCI-C07272
- CP 25
- CCRIS 2366
- HSDB 131
- NSC 406333
- UN 1294
- EINECS 203-625-9
- UNII-3FPU23BG52
- EPA Pesticide Chemical Code 080601
- NSC-406333
- 3FPU23BG52
- DTXSID7021360
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|
| Properties |
| Property |
Value |
| MW |
92.14 g/mol |
| HBD |
0 |
| HBA |
0 |
| Rotatable Bond Count |
0 |
| Exact Mass |
92.062600255 g/mol |
| Monoisotopic Mass |
92.062600255 g/mol |
| Heavy Atom Count |
7 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
42 |
| xlogp |
2.7 |
| Topological Polar Surface Area |
0 |
|