AG0029N6

204688-61-9 | 3-Pyrrolidineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-, (3S)-

AG0029N6

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CAS Number	204688-61-9
Catalog Number	AG0029N6(AGN-PC-0O7FCR)
Chemical Name	3-Pyrrolidineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-, (3S)-
IUPAC Name	2-[(3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]acetic acid
InChI	InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-5-4-8(7-12)6-9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m0/s1
InChI Key	SKEXQIJIXQSFRX-QMMMGPOBSA-N
MDL Number	MFCD05861546
Molecular Formula	C11H19NO4
Molecular Weight	229.2729
SMILES	O=C(O)C[C@H]1CN(C(OC(C)(C)C)=O)CC1
Synonyms	204688-61-9, (s)-2-(1-(tert-butoxycarbonyl)pyrrolidin-3-yl)acetic acid, (S)-(1-Boc-Pyrrolidin-3-yl)-acetic acid, (S)-1-Boc-3-Carboxymethylpyrrolidine, (S)-N-Boc-3-pyrrolidineacetic acid, (S)-1-N-Boc-3-pyrrolidineacetic acid, s-1-boc-pyrrolidin-3-acetic acid, 2-[(3S)-1-[(tert-butoxy)carbonyl]pyrrolidin-3-yl]acetic acid, (s)-3-carboxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester, 3-PYRROLIDINEACETIC ACID, 1-[(1,1-DIMETHYLETHOXY)CARBONYL]-, (3S)-, (S)-1-N-Boc-3-pyrrolidineaceticacid, 2-[(3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]acetic acid, (S)-N-Boc-3-pyrrolidineaceticacid, AK-44808, PubChem13360, AC1LT44C, SCHEMBL874037, CTK1A1791, DTXSID30363615, SKEXQIJIXQSFRX-QMMMGPOBSA-N, ACT01703, CS-B0997, ZINC1420821, (S)-1-Boc-3-pyrrolidineacetic acid, ANW-54152, MFCD05861546, RW1032, (s)-n-boc-pyrrolidine-3-acetic acid, AKOS015898194, AC-6303, CB-1358, FCH1624247, GS-3891, PB34101, QC-3207, RL02541, AJ-25820, AN-10165, BC202071, BR-44808, (S)-(1-Boc-pyrrolidin-3-yl)acetic acid, AB0005675, AX8036035, DB-031458, RT-015504, ST2414567, FT-0630192, W4305, (3S)-1-BOC-3-PYRROLIDINEACETIC ACID, B67363, EN300-155897, S-4779, 688B619, (s)-1-tert-butoxycarbonylpyrrolidine-3-acetic acid, I11-0513, I11-0524, (S)-(1-Boc-pyrrolidin-3-yl)-acetic acid, AldrichCPR, [(3s)-1-(tert-butoxycarbonyl)pyrrolidin-3-yl]acetic acid, 2-[(3S)-1-tert-butoxycarbonylpyrrolidin-3-yl]acetic acid, (S)-3-carboxymethyl-pyrrolidine-1-carboxylic acid tert butyl ester, 3-Pyrrolidineaceticacid, 1-[(1,1-dimethylethoxy)carbonyl]-, (3S)-, ((3S)-1-{[(1,1-dimethylethyl)oxy]carbonyl}-3-pyrrolidinyl)acetic acid, C11H19NO4, -1-N-Boc-3-pyrrolidineaceticacid, ACN-001820, CID1502098, A11772, 3-carboxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester, 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]acetic Acid,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	229.131g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	229.276g/mol
Monoisotopic Mass	229.131g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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