AG00CIV5

406913-88-0 | (2R)-1,4-Dioxane-2-methanol

AG00CIV5

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CAS Number	406913-88-0
Catalog Number	AG00CIV5(AGN-PC-0OA6MF)
Chemical Name	(2R)-1,4-Dioxane-2-methanol
IUPAC Name	[(2R)-1,4-dioxan-2-yl]methanol
InChI	InChI=1S/C5H10O3/c6-3-5-4-7-1-2-8-5/h5-6H,1-4H2/t5-/m1/s1
InChI Key	CMEPUAROFJSGJN-RXMQYKEDSA-N
MDL Number	MFCD16620507
Molecular Formula	C5H10O3
Molecular Weight	118.1311
SMILES	OC[C@H]1OCCOC1
Synonyms	(R)-(1,4-Dioxan-2-yl)methanol, 406913-88-0, (2R)-1,4-Dioxane-2-methanol, (R)-2-(Hydroxymethyl)-1,4-dioxane, (2R)-1,4-dioxan-2-ylmethanol, (R)-[1,4]Dioxan-2-yl-methanol, 1,4-Dioxane-2-methanol, (2R)-, AK153415, CHEMBL364472, SCHEMBL1564755, CMEPUAROFJSGJN-RXMQYKEDSA-N, (R)-[1,4Dioxan-2-yl-methanol, (2R)-1,4-dioxan-2-yl methanol, ZINC6718467, 8542AH, MFCD16620507, AKOS024260348, DS-7739, FCH1188372, SB22878, KS-0000093F, AC-29516, AJ-56730, AX8240728, J1235, ST24035111, Z-6314, 913D880, S14-2635, C5H10O3,

Complexity	64.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	118.063g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	118.132g/mol
Monoisotopic Mass	118.063g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	38.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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