AG002KWP

210647-03-3 | 2-(1,4-Dioxan-2-yl)acetic acid

AG002KWP

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CAS Number	210647-03-3
Catalog Number	AG002KWP(AGN-PC-01WGU2)
Chemical Name	2-(1,4-Dioxan-2-yl)acetic acid
IUPAC Name	2-(1,4-dioxan-2-yl)acetic acid
InChI	InChI=1S/C6H10O4/c7-6(8)3-5-4-9-1-2-10-5/h5H,1-4H2,(H,7,8)
InChI Key	FWFUSMMVFVVERM-UHFFFAOYSA-N
MDL Number	MFCD30556333
Molecular Formula	C6H10O4
Molecular Weight	146.1412
SMILES	O1C(COCC1)CC(=O)O
Synonyms	2-(1,4-Dioxan-2-yl)acetic acid, 210647-03-3, 1,4-Dioxane-2-acetic acid, dioxane-acetic acid, 1,4-dioxane-acetic acid, SCHEMBL323060, (1,4-Dioxan-2-yl)acetic acid, DTXSID40594150, FWFUSMMVFVVERM-UHFFFAOYSA-N, MFCD19228692, rac-(1,4-dioxan-2-yl)-acetic acid, AKOS006375877, SB21833, KS-0000082S, (RS)-2-[1,4]dioxan-2-yl-acetic acid, AK141848, AS-34862, CS-0052333, ST24039039,

Complexity	123
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	146.058g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	146.142g/mol
Monoisotopic Mass	146.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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