8ZE

2,3-dihydro-1,4-benzodioxin-6-ylmethanol

Created:	2013-07-31
Last modified:	2014-02-26

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1 entries where 8ZE is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	23
Aromatic Bond Count	6

2D diagram of 8ZE

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Chemical Component Summary
Name	2,3-dihydro-1,4-benzodioxin-6-ylmethanol
Systematic Name (OpenEye OEToolkits)	2,3-dihydro-1,4-benzodioxin-6-ylmethanol
Formula	C₉ H₁₀ O₃
Molecular Weight	166.174
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O1c2c(OCC1)cc(cc2)CO
SMILES	CACTVS	3.385	OCc1ccc2OCCOc2c1
SMILES	OpenEye OEToolkits	1.7.6	c1cc2c(cc1CO)OCCO2
Canonical SMILES	CACTVS	3.385	OCc1ccc2OCCOc2c1
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1cc2c(cc1CO)OCCO2
InChI	InChI	1.03	InChI=1S/C9H10O3/c10-6-7-1-2-8-9(5-7)12-4-3-11-8/h1-2,5,10H,3-4,6H2
InChIKey	InChI	1.03	FFLHNBGNAWYMRH-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	2776174

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.