AG00C6ZJ

364750-80-1 | (2S,4R)-N-Boc-4-Methylpyrrolidine-2-Carboxylic Acid

AG00C6ZJ

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CAS Number	364750-80-1
Catalog Number	AG00C6ZJ(AGN-PC-0RC8VZ)
Chemical Name	(2S,4R)-N-Boc-4-Methylpyrrolidine-2-Carboxylic Acid
IUPAC Name	(2S,4R)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
InChI	InChI=1S/C11H19NO4/c1-7-5-8(9(13)14)12(6-7)10(15)16-11(2,3)4/h7-8H,5-6H2,1-4H3,(H,13,14)/t7-,8+/m1/s1
InChI Key	MXKSXPYZNXUHEZ-SFYZADRCSA-N
MDL Number	MFCD13185988
Molecular Formula	C11H19NO4
Molecular Weight	229.2729
SMILES	O=C([C@H]1N(C(OC(C)(C)C)=O)C[C@H](C)C1)O
Synonyms	364750-80-1, (2S,4R)-1-(TERT-BUTOXYCARBONYL)-4-METHYLPYRROLIDINE-2-CARBOXYLIC ACID, (2S,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid, (2S,4R)-N-BOC-4-METHYLPYRROLIDINE-2-CARBOXYLIC ACID, (2S,4R)-1-Boc-4-methylpyrrolidine-2-carboxylic acid, SCHEMBL1294186, CTK4H6519, DTXSID60448106, (4R)-1-Boc-4-Methyl-L-proline, KS-000007HL, ZX-AT020338, MFCD13185988, ZINC32098872, AKOS015991600, FCH3996811, OR61167, PB33159, SS-4367, AJ-84645, AK-90274, SC-49167, AX8044770, CS-0038277, FT-0686345, X3390, Q-3282, (4R)-1-(tert-Butoxycarbonyl)-4-methyl-L-proline, 750B801, trans-1-(tert-Butoxycarbonyl)-4-methyl-L-proline, (2S,4R)-N-Boc-4-methylpyrrolidine-2-carboxylic aci, 4beta-Methylpyrrolidine-1,2alpha-dicarboxylic acid 1-tert-butyl ester, 1,2-Pyrrolidinedicarboxylicacid, 4-methyl-, 1-(1,1-dimethylethyl) ester, (2S,4R)-, C11H19NO4, CID10911346, (2R,4S)-1-Boc-4-methylpyrrolidine-2-carboxylic acid, (2r,4s)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid, (2S,4R)-1-(tert-Butoxycarbonyl)-4-methylpyrrolidine-2-carboxylicacid, 1018818-04-6, (2S,4R)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic Acid,

Complexity	295
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
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	3
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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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