AG007ICM

3391-30-8 | 1,3-Dioxan-5-ol, 2,2-dimethyl-

3391-30-8

AG007ICM

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CAS Number	3391-30-8
Catalog Number	AG007ICM(AGN-PC-0NEPTX)
Chemical Name	1,3-Dioxan-5-ol, 2,2-dimethyl-
IUPAC Name	2,2-dimethyl-1,3-dioxan-5-ol
InChI	InChI=1S/C6H12O3/c1-6(2)8-3-5(7)4-9-6/h5,7H,3-4H2,1-2H3
InChI Key	CGNOMSJAJQUXAT-UHFFFAOYSA-N
MDL Number	MFCD22071341
Molecular Formula	C6H12O3
Molecular Weight	132.1577
SMILES	OC1COC(OC1)(C)C
Synonyms	2,2-dimethyl-1,3-dioxan-5-ol, 3391-30-8, 1,3-Dioxan-5-ol, 2,2-dimethyl-, CGNOMSJAJQUXAT-UHFFFAOYSA-N, 2,2-dimethyl-[1,3]dioxan-5-ol, SCHEMBL712586, CTK1B8095, DTXSID90452433, 2,2-dimethyl-1,3-dioxane-5-ol, MFCD22071341, ZINC82410972, AKOS022719144, NE60059, 1,3-Dioxane, 2,2-dimethyl-5-hydroxy-, CID11029884,

Complexity	90.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	132.079g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	132.159g/mol
Monoisotopic Mass	132.079g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	38.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited