AG003RJB

741288-31-3 | 3-Morpholinecarboxylicacid,methylester,(3S)-(9CI)

AG003RJB

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CAS Number	741288-31-3
Catalog Number	AG003RJB(AGN-PC-0U4ICX)
Chemical Name	3-Morpholinecarboxylicacid,methylester,(3S)-(9CI)
IUPAC Name	methyl (3S)-morpholine-3-carboxylate
InChI	InChI=1S/C6H11NO3/c1-9-6(8)5-4-10-3-2-7-5/h5,7H,2-4H2,1H3/t5-/m0/s1
InChI Key	VVYXIRKYWOEDRA-YFKPBYRVSA-N
MDL Number	MFCD06799487
Molecular Formula	C6H11NO3
Molecular Weight	145.1564
SMILES	O=C([C@H]1NCCOC1)OC
Synonyms	(S)-METHYL MORPHOLINE-3-CARBOXYLATE, 741288-31-3, methyl (3S)-morpholine-3-carboxylate, methyl (S)-morpholine-3-carboxylate, AK-64358, AC1O6NS2, SCHEMBL2918625, CTK6I6359, KS-00000AIW, DTXSID00424924, VVYXIRKYWOEDRA-YFKPBYRVSA-N, Methyl(S)-3-Morpholinecarboxylate, ZX-CM011321, ANW-46624, FCH921983, KM1593, MFCD06799487, ZINC22015881, AKOS016842453, SB11304, AJ-80644, CJ-17270, TS-01894, AX8212164, DB-074783, TC-135369, CS-0044006, FT-0695092, ST24020868, W8193, (3S)-Morpholine-3-carboxylic acid methyl ester, (S)-3-Morpholinecarboxylic acid methyl ester HCl, 3(S)-MORPHOLINECARBOXYLIC ACID METHYL ESTER, C6H11NO3, Methyl Morpholine-3-carboxylate, Methyl (S)-3-Morpholinecarboxylate, ACN-031148, CID6558896, 3-Morpholinecarboxylicacid,methylester,(3S)-, (S)-methyl morpholine-3-carboxylate hydrochloride, 3-Morpholinecarboxylic acid, methyl ester, (3S)- (9CI), 1041173-28-7, 126264-49-1,

Complexity	126
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	145.074g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	145.158g/mol
Monoisotopic Mass	145.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	47.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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