AG00031A

100858-33-1 | 1-Pyrrolidinecarboxylic acid, 3-hydroxy-, phenylmethyl ester, (3R)-

AG00031A

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CAS Number	100858-33-1
Catalog Number	AG00031A(AGN-PC-0NV2Z6)
Chemical Name	1-Pyrrolidinecarboxylic acid, 3-hydroxy-, phenylmethyl ester, (3R)-
IUPAC Name	benzyl (3R)-3-hydroxypyrrolidine-1-carboxylate
InChI	InChI=1S/C12H15NO3/c14-11-6-7-13(8-11)12(15)16-9-10-4-2-1-3-5-10/h1-5,11,14H,6-9H2/t11-/m1/s1
InChI Key	MBLJFGOKYTZKMH-LLVKDONJSA-N
MDL Number	MFCD07368258
Molecular Formula	C12H15NO3
Molecular Weight	221.2524
SMILES	O[C@@H]1CCN(C1)C(=O)OCC1=CC=CC=C1
Synonyms	100858-33-1, (R)-(-)-1-Cbz-3-pyrrolidinol, benzyl (3R)-3-hydroxypyrrolidine-1-carboxylate, (R)-Benzyl 3-hydroxypyrrolidine-1-carboxylate, (R)-1-CBZ-3-PYRROLIDINOL, (R)-N-Cbz-3-hydroxypyrrolidine, (R)-1-Carbobenzoxy-3-pyrrolidinol, (R)-1-CBZL-3-PYRROLIDINOL, (R)-(-)-1-Cbz-3-Hydroxy-pyrrolidine, 1-PYRROLIDINECARBOXYLIC ACID, 3-HYDROXY-, PHENYLMETHYL ESTER, (3R)-, PubChem18734, (R)-N-Z-3-Pyrrolidinol, 1-Pyrrolidinecarboxylicacid, 3-hydroxy-, phenylmethyl ester, (3R)-, 3-Hydroxy-Cbz-(R)Pyrrolidine, SCHEMBL1841984, (3R)-3-HYDROXY-1-PYRROLIDINECARBOXYLICACID PHENYLMETHYL ESTER, 3-Hydroxy-Cbz-(R)-pyrrolidine, CTK3J9308, (R)-3-Hydroxy-pyrrolidine-1-carboxylic acid benzyl ester, DTXSID20457976, MBLJFGOKYTZKMH-LLVKDONJSA-N, (3R)-N-CBZ-3-PYRROLIDINOL, 0281AA, ANW-43207, CC0033, MFCD07368258, ZINC16697505, AKOS016842292, ACN-052013, CC-1669, CS-W003377, DS-0808, FS-2448, PB13059, (R)-1-Benzyloxycarbonyl-3-pyrrolidinol, KS-0000032I, (R)-1-Carbobenzoxy-3-hydroxypyrrolidine, AC-22438, AJ-69355, BR-32647, CJ-15599, (R)-(-)-1-Cbz-3-pyrrolidinol, 95%, (R)-(−)-1-Cbz-3-pyrrolidinol, AB0063004, DB-024529, RT-004952, ST2408107, (R)-N-benzyloxycarbonyl-3-hydroxypyrrolidine, FT-0648067, n-benzyloxycarbonyl-(r)-3-hydroxypyrrolidine, TL80090966, (3R)-N-benzyloxycarbonyl-3-hydroxypyrrolidine, benzyl (R)-3-hydroxypyrrolidine-1-carboxylate, (3R)-N- benzyloxycarbonyl-3-hydroxypyrrolidine, benzyl (R)-3-hydroxy-pyrrolidine-1-carboxylate, Benzyl(3R)-3-hydroxypyrrolidine-1-carboxylate, S-1808, Benzyl (3R)-3-hydroxy-1-pyrrolidinecarboxylate, 858C331, J-000239, (R)-(-)-1-Benzyloxycarbonyl-3-hydroxypyrrolidine, 95%, 3alpha-Hydroxypyrrolidine-1-carboxylic acid benzyl ester, (R)-3-hydroxy-1-pyrrolidinecarboxylic acid, phenylmethyl ester, C13H17NO3, ?(-)-N-Cbz-3-hydroxypyrrolidine, ACN-S002112, CB12008, CID11183628, Benzyl 3-hydroxy-1-pyrrolidinecarboxylate, C2585, (R)-Benzyl 3-hydroxypiperidine-1-carboxylate, (R)-1-Cbz-3-pyrrolidinol, 98%, ee: 98% - 1G 1g, 100858-34-2,

Complexity	238
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	221.105g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	221.256g/mol
Monoisotopic Mass	221.105g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P301+P310-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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