AG00HS4G

130622-05-8 | D-Glutamic acid, N-[(1,1-dimethylethoxy)carbonyl]-, dimethyl ester

AG00HS4G

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CAS Number	130622-05-8
Catalog Number	AG00HS4G(AGN-PC-0O0YF2)
Chemical Name	D-Glutamic acid, N-[(1,1-dimethylethoxy)carbonyl]-, dimethyl ester
IUPAC Name	dimethyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate
InChI	InChI=1S/C12H21NO6/c1-12(2,3)19-11(16)13-8(10(15)18-5)6-7-9(14)17-4/h8H,6-7H2,1-5H3,(H,13,16)/t8-/m1/s1
InChI Key	QNSPKWUAZQIIGZ-MRVPVSSYSA-N
MDL Number	MFCD03094773
Molecular Formula	C12H21NO6
Molecular Weight	275.2982
SMILES	COC([C@H](NC(OC(C)(C)C)=O)CCC(OC)=O)=O
Synonyms	130622-05-8, (R)-N-Boc-glutamic acid-1,5-dimethyl ester, (R)-N-Boc-glutamic acid 1,5-dimethyl ester, Boc-D-Glu(OMe)-OMe, N-Boc-L-glutamic acid 1,5-dimethyl ester, PubChem13420, SCHEMBL1317487, QNSPKWUAZQIIGZ-MRVPVSSYSA-N, CS-B1601, ZINC2243539, MFCD03094773, AKOS027251253, AS-10081, 279B606, tert-Butyl (R)-1,3-di(methoxycarbonyl)propylcarbamate, Dimethyl N-{[(1,1-dimethylethyl)oxy]carbonyl}-D-glutamate, (R)-2-tert-Butoxycarbonylamino-pentanedioic acid dimethyl ester, D-Glutamic acid, N-[(1,1-dimethylethoxy)carbonyl]-, dimethyl ester, Boc-Glu(OMe)-OMe, N-Boc-L-Glutamic Acid dimethyl ester, 59279-60-6,

Complexity	334
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	275.137g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	275.301g/mol
Monoisotopic Mass	275.137g/mol
Rotatable Bond Count	9
Topological Polar Surface Area	90.9A^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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

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