UUG
(4-bromo-2-methoxyphenyl)methanol
Created: | 2020-06-02 |
Last modified: | 2020-06-17 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 20 |
Chiral Atom Count | 0 |
Bond Count | 20 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | (4-bromo-2-methoxyphenyl)methanol |
Systematic Name (OpenEye OEToolkits) | (4-bromanyl-2-methoxy-phenyl)methanol |
Formula | C8 H9 Br O2 |
Molecular Weight | 217.06 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1(c(OC)cc(cc1)Br)CO |
SMILES | CACTVS | 3.385 | COc1cc(Br)ccc1CO |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(ccc1CO)Br |
Canonical SMILES | CACTVS | 3.385 | COc1cc(Br)ccc1CO |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(ccc1CO)Br |
InChI | InChI | 1.03 | InChI=1S/C8H9BrO2/c1-11-8-4-7(9)3-2-6(8)5-10/h2-4,10H,5H2,1H3 |
InChIKey | InChI | 1.03 | HBEIHPSICGGZIF-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 15128243 |