AG000MPQ

124752-23-4 | tert-Butyl (4R, 6S)-6-formaldehydel-2,2-dimethyl-1,3-dioxane-4-acetate

AG000MPQ

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CAS Number	124752-23-4
Catalog Number	AG000MPQ(AGN-PC-0PHVP5)
Chemical Name	tert-Butyl (4R, 6S)-6-formaldehydel-2,2-dimethyl-1,3-dioxane-4-acetate
IUPAC Name	tert-butyl 2-[(4R,6S)-6-formyl-2,2-dimethyl-1,3-dioxan-4-yl]acetate
InChI	InChI=1S/C13H22O5/c1-12(2,3)18-11(15)7-9-6-10(8-14)17-13(4,5)16-9/h8-10H,6-7H2,1-5H3/t9-,10+/m1/s1
InChI Key	JEFQIIXBSQLRTF-ZJUUUORDSA-N
MDL Number	MFCD02093270
Molecular Formula	C13H22O5
Molecular Weight	258.3108
SMILES	CC(C)(C)OC(=O)C[C@H]1C[C@H](OC(C)(C)O1)C=O
Synonyms	124752-23-4, tert-Butyl (4R-cis)-6-formaldehydel-2,2-dimethyl-1,3-dioxane-4-acetate, tert-butyl 2-((4R,6S)-6-formyl-2,2-dimethyl-1,3-dioxan-4-yl)acetate, Tert-butyl 2-[(4R,6S)-6-formyl-2,2-dimethyl-1,3-dioxan-4-yl]acetate, (4r-CiS)-6-formaldehydel-2,2-dimethyl-1, 3-dioxane-4-acetic acid,1,1-dimethylethyl ester, JEFQIIXBSQLRTF-ZJUUUORDSA-N, 123185-87-5, AK-50587, SCHEMBL31545, KS-00000HVS, DTXSID00432302, MFCD02093270, ZINC34610519, AKOS015896411, DS-1222, RP29211, AC-24413, AJ-89718, BR-50587, SC-26059, AB0032870, AX8161485, FT-0604722, ST24031698, X6302, X9607, J3.653.763I, S-3161, 752C234, I06-2007, Q-102785, tert-Butyl (4R-cis)-6-formaldehydel-2,2-dimethyl-1, tert-Butyl (3R,5S)-6-oxo-3,5-o-iso-propylidene-3,5-dihydroxyhexanoate, tert-Butyl (4R-cis)-6-formaldehyde-2,2-dimethyl-1,3-dioxane-4-acetate, tert-Butyl 3,5-dideoxy-2,4-O-(1-methylethylidene)-L-erythro-hexuronate, Tert.butyl-2 [(4R, 6S)-6-Formyl-2,2-dimethyl-1,3-dioxan-4-yl]acetate, Tert.butyl-2 [(4R,6S)-6-Formyl-2,2-dimethyl-1,3-dioxan-4-yl]acetate, (2,2-Dimethyl-6beta-formyl-1,3-dioxane-4beta-yl)acetic acid tert-butyl ester, (4R-cis)-6-Formaldehydel-2,2-dimethyl-1,3-dioxane-4-acetic acid 1,1-dimethylethyl ester, DL-erythro-Hexuronic acid, 3,5-dideoxy-2,4-O-(1-methylethylidene)-,1,1-dimethylethyl ester, Rosuvastatin Intermediates?, C13H22O5, ACN-048311, CID9881588, tert-Butyl (4R-cis)-6-formaldehyde-2,2-dimethyl-1,3-dioxane-4-acetate 1g, tert-Butyl (4R-cis)-6-formaldehydel-2,2-dimethyl-1,3-dioxane-4-acetate?, tert-Butyl [(4R, 6S)-6-forMyl-2,2-diMethyl-1,3-dioxan-4-yl]acetate, tert-Butyl (4R-cis)-6-formaldehydel-2,2-dimethyl-1,3-dioxane-4-acetate, 99% - 1G 1g,

Complexity	316
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	258.147g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	258.314g/mol
Monoisotopic Mass	258.147g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	61.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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