IPB
Summary
Name: | 5-METHYL-2-(1-METHYLETHYL)PHENOL |
Formula: | C10 H14 O |
Formal charge: | 0 |
Formula weight: | 150.218 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 5-methyl-2-(1-methylethyl)phenol |
OpenEye OEToolkits | 1.5.0 | 5-methyl-2-propan-2-yl-phenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Oc1cc(ccc1C(C)C)C |
SMILES_CANONICAL | CACTVS | 3.341 | CC(C)c1ccc(C)cc1O |
SMILES | CACTVS | 3.341 | CC(C)c1ccc(C)cc1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1ccc(c(c1)O)C(C)C |
SMILES | OpenEye OEToolkits | 1.5.0 | Cc1ccc(c(c1)O)C(C)C |
InChI | InChI | 1.03 | InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3 |
InChIKey | InChI | 1.03 | MGSRCZKZVOBKFT-UHFFFAOYSA-N |