AG003PTV

10487-05-5 | DL-Glyceraldehyde diethyl acetal

AG003PTV

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CAS Number	10487-05-5
Catalog Number	AG003PTV(AGN-PC-060HAL)
Chemical Name	DL-Glyceraldehyde diethyl acetal
IUPAC Name	3,3-diethoxypropane-1,2-diol
InChI	InChI=1S/C7H16O4/c1-3-10-7(11-4-2)6(9)5-8/h6-9H,3-5H2,1-2H3
InChI Key	BPNZBKXZVJVEJD-UHFFFAOYSA-N
MDL Number	MFCD00059599
Molecular Formula	C7H16O4
Molecular Weight	164.1995
SMILES	OC(CO)C(OCC)OCC
Synonyms	3,3-diethoxy-1,2-propanediol, 3,3-diethoxypropane-1,2-diol, DL-Glyceraldehyde Diethyl Acetal, 10487-05-5, 3,3-Diethoxy-1,2-propanediol, 3,3-diethoxy-propane-1,2-diol, BPNZBKXZVJVEJD-UHFFFAOYSA-N, dl-Glyceraldehyde diethylacetal, AC1LBV5M, SCHEMBL9443589, 3,3-diethoxyl-1,2-propanediol, CTK1I9279, 1,2-Propanediol, 3,3-diethoxy-, 3,3-Diethoxy-1,2-propanediol #, MFCD00059599, AKOS025116716, MCULE-9826541946, RT-001954, FT-0657378, G0216, A801082, C-44454, J-001280, S14-1492, 62334-33-2, CID542749,

Complexity	80.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.105g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	164.201g/mol
Monoisotopic Mass	164.105g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	58.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number