AG00EGA7

5694-68-8 | 2-HYDROXYMETHYL-1,3-DIOXOLANE

AG00EGA7

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CAS Number	5694-68-8
Catalog Number	AG00EGA7(AGN-PC-0JPE62)
Chemical Name	2-HYDROXYMETHYL-1,3-DIOXOLANE
IUPAC Name	1,3-dioxolan-2-ylmethanol
InChI	InChI=1S/C4H8O3/c5-3-4-6-1-2-7-4/h4-5H,1-3H2
InChI Key	ZAGUSKAXELYWCE-UHFFFAOYSA-N
MDL Number	MFCD08062572
Molecular Formula	C4H8O3
Molecular Weight	104.1045
NSC Number	163968
SMILES	OCC1OCCO1
Synonyms	(1,3-Dioxolan-2-yl)methanol, 5694-68-8, 1,3-Dioxolane-2-methanol, 2-HYDROXYMETHYL-1,3-DIOXOLANE, 1,3-Dioxolan-2-ylmethanol, ZAGUSKAXELYWCE-UHFFFAOYSA-N, 1,3-dioxolan-2-ylmethan-1-ol, NSC163968, AC1L6MUG, SCHEMBL714076, 2-Hydroxymethyl-1,3-dioxolan, 1,3-Dioxolan-2-ylmethanol #, 2(Hydroxymethyl)-1,3-dioxolane, CTK1G9816, KS-00000SIS, DTXSID90304029, 2-(Hydroxymethyl)-1,3-dioxolane, BCP19203, ZINC1640035, MFCD08062572, SBB059646, AKOS005138016, CS-W019186, DS-9688, MCULE-8334027179, NSC-163968, AJ-28551, AK159792, SC-87636, Acetaldehyde, cyclic 1,2-ethanediyl acetal, TX-010161, FT-0768468, ST24033397, ST51044567, Acetaldehyde, hydroxy-, cyclic 1,2-ethanediyl acetal, C(O)C1OCCO1, [1,3]Dioxolan-2-yl-methanol, CID294864, ACN-046764,

Complexity	48.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	104.047g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	104.105g/mol
Monoisotopic Mass	104.047g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	38.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

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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