AG000J0X

122709-21-1 | 3-Oxazolidinecarboxylic acid, 4-[(methoxymethylamino)carbonyl]-2,2-dimethyl-, 1,1-dimethylethyl ester, (4S)-

AG000J0X

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CAS Number	122709-21-1
Catalog Number	AG000J0X(AGN-PC-0PGLEW)
Chemical Name	3-Oxazolidinecarboxylic acid, 4-[(methoxymethylamino)carbonyl]-2,2-dimethyl-, 1,1-dimethylethyl ester, (4S)-
IUPAC Name	tert-butyl (4S)-4-[methoxy(methyl)carbamoyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
InChI	InChI=1S/C13H24N2O5/c1-12(2,3)20-11(17)15-9(8-19-13(15,4)5)10(16)14(6)18-7/h9H,8H2,1-7H3/t9-/m0/s1
InChI Key	USINQMZZDNKSQW-VIFPVBQESA-N
MDL Number	MFCD09878777
Molecular Formula	C13H24N2O5
Molecular Weight	288.3401
SMILES	O=C(N1C(C)(C)OC[C@H]1C(N(OC)C)=O)OC(C)(C)C
Synonyms	122709-21-1, (S)-3-Boc-4-(Methoxymethylcarbamoyl)-2,2-dimethyloxazolidine, (S)-tert-Butyl 4-(methoxy(methyl)carbamoyl)-2,2-dimethyloxazolidine-3-carboxylate, (S)-4-(Methoxy-methyl-carbamoyl)-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester, USINQMZZDNKSQW-VIFPVBQESA-N, PubChem23408, SCHEMBL1366613, DTXSID20566133, (R)-tert-Butyl 4-(methoxy(methyl)carbamoyl)-2,2-dimethyloxazolidine-3-carboxylate, tert-butyl (4S)-4-[methoxy(methyl)carbamoyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate, ACT07899, ANW-47971, MFCD09878777, ZINC16697238, AKOS015919688, AJ-69295, AS-37020, BR-55457, AB0004891, AX8048909, RT-015546, ST2402905, TC-136716, X9532, A-2494, (s)-3-(tert-butoxycarbonyl)-n-methoxy-2,2,n-trimethyloxazolidine-4-carboxamide, (S)-4-(Methoxy-methyl-carbamoyl)-2,2-dimethyl- oxazolidine-3-carboxylic acid tert-butyl ester, C13H24N2O5, 167102-62-7,

Complexity	389
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	288.169g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	288.344g/mol
Monoisotopic Mass	288.169g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	68.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

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

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