AG0010WV

132622-78-7 | 1,2-Pyrrolidinedicarboxylic acid, 4-amino-, 1-(1,1-dimethylethyl) ester, (2R,4S)-

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CAS Number	132622-78-7
Catalog Number	AG0010WV(AGN-PC-0PJRD5)
Chemical Name	1,2-Pyrrolidinedicarboxylic acid, 4-amino-, 1-(1,1-dimethylethyl) ester, (2R,4S)-
IUPAC Name	(2R,4S)-4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
InChI	InChI=1S/C10H18N2O4/c1-10(2,3)16-9(15)12-5-6(11)4-7(12)8(13)14/h6-7H,4-5,11H2,1-3H3,(H,13,14)/t6-,7+/m0/s1
InChI Key	WDWRIVZIPSHUOR-NKWVEPMBSA-N
MDL Number	MFCD08704543
Molecular Formula	C10H18N2O4
Molecular Weight	230.2609
SMILES	O=C([C@@H]1N(C(OC(C)(C)C)=O)C[C@@H](N)C1)O
Synonyms	132622-78-7, (2R,4S)-4-amino-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylic acid, (2R,4S)-1-BOC-4-AMINO-PYRROLIDINE-2-CARBOXYLIC ACID, (2R,4S)-1-Boc-4-Aminopyrrolidine-2-carboxylic acid, (2R,4S)-1-BOC-4-AMINO PYRROLIDINE-2-CARBOXYLIC ACID, 1,2-Pyrrolidinedicarboxylicacid, 4-amino-, 1-(1,1-dimethylethyl) ester, (2R-trans)- (9CI), AK-42136, (4S)-4-Amino-1-(tert-butoxycarbonyl)-D-proline, SCHEMBL3382176, CTK4B8014, DTXSID40564611, (2R,4S)-4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid, WDWRIVZIPSHUOR-NKWVEPMBSA-N, ZINC2548224, ZX-CM014305, MFCD08704543, AKOS015841359, FCH3614933, FCH4006495, RP27897, AJ-39503, AS-49566, AB0000742, AB1006686, AX8209480, DB-062920, ST2402250, TC-065580, CS-0028232, FT-0084110, FT-0656097, X9839, (4S)-4-Amino-1-(t-butoxycarbonyl)-D-proline, A-5787, A26641, (4S)-1-(tert-Butoxycarbonyl)-4-amino-D-proline, I11-0182, 1-N-Boc-4(S)-Aminopyrrolidine-2(R)-carboxylic acid, C10H18N2O4, ACN-031275, (2R,4S)-1-Boc-4-Aminopyrrolidine-2-carboxylicacid, (2S,4R)-1-Boc-4-aminopyrrolidine-2-carboxylic acid, 1,2-Pyrrolidinedicarboxylicacid, 4-amino-, 1-(1,1-dimethylethyl)ester, (2R,4S)-, 132622-69-6,

Complexity	298
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	230.127g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	230.264g/mol
Monoisotopic Mass	230.127g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	92.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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