DKF

hexane-1,1-diol

Created:	2019-08-07
Last modified:	2020-07-22

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	21
Aromatic Bond Count	0

2D diagram of DKF

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Chemical Component Summary
Name	hexane-1,1-diol
Systematic Name (OpenEye OEToolkits)	hexane-1,1-diol
Formula	C₆ H₁₄ O₂
Molecular Weight	118.174
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCCCCC(O)O
SMILES	OpenEye OEToolkits	2.0.7	CCCCCC(O)O
Canonical SMILES	CACTVS	3.385	CCCCCC(O)O
Canonical SMILES	OpenEye OEToolkits	2.0.7	CCCCCC(O)O
InChI	InChI	1.03	InChI=1S/C6H14O2/c1-2-3-4-5-6(7)8/h6-8H,2-5H2,1H3
InChIKey	InChI	1.03	ACCCMOQWYVYDOT-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	147023

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