AG003Q0H

5747-92-2 | Ethyl 1-benzylpyrrolidine-3-carboxylate

AG003Q0H

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CAS Number	5747-92-2
Catalog Number	AG003Q0H(AGN-PC-00CV2T)
Chemical Name	Ethyl 1-benzylpyrrolidine-3-carboxylate
IUPAC Name	ethyl 1-benzylpyrrolidine-3-carboxylate
InChI	InChI=1S/C14H19NO2/c1-2-17-14(16)13-8-9-15(11-13)10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3
InChI Key	CYPXEPWPTXKUPL-UHFFFAOYSA-N
MDL Number	MFCD04039852
Molecular Formula	C14H19NO2
Molecular Weight	233.3062
SMILES	O=C(C1CN(CC2=CC=CC=C2)CC1)OCC
Synonyms	Ethyl 1-benzylpyrrolidine-3-carboxylate, 5747-92-2, 1-benzyl-pyrrolidine-3-carboxylic acid ethyl ester, Ethyl 1-benzyl-pyrrolidine-3-carboxylate, 1-benzylpyrrolidine-3-carboxylic acid ethyl ester, MFCD04039852, ethyl1-benzylpyrrolidine-3-carboxylate, 3-Pyrrolidinecarboxylic acid, 1-(phenylmethyl)-, ethyl ester, ACMC-1ASR8, 1-Benzyl-pyrrolidine-3-carboxylicacidethylester, AC1Q34LW, AC1Q34LX, KSC495S0T, SCHEMBL1545229, CTK3J5909, 1-benzyl-3-carboethoxypyrrolidine, CYPXEPWPTXKUPL-UHFFFAOYSA-N, ACN-S002942, ACT10890, KS-00000AF9, ANW-75507, CE-286, RW3003, AKOS015843412, AB17393, AC-1442, CS-W001598, DS-0693, QC-3099, RP07774, RTC-063280, TRA0009688, ethyl-N-benzyl-3-pyrrolidine carboxylate, AN-14940, BC677033, BR-29421, EN001256, SC-28047, SY005553, AB0031578, DB-013395, N-BENZYL-3-ETHOXYCARBONYLPYRROLIDINE, ST2412867, TC-063280, TL8003698, AM20040751, FT-0635833, X4714, 1-Benzylpyrrolidine-3-carboxylicacidethylester, EN300-73332, A-6530, B65705, (+/-) Ethyl N-benzyl-3-pyrrolidinylcarboxylate, MFCD04039852 (97+%), 747E922, N-Benzyl Pyrrolidine-3-carboxylic acid ethyl ester, I01-1477, J-520526, Ethyl 1-benzyl-pyrrolidine-3-carboxylate, AldrichCPR, C14H19NO2, CID11622765, ethyl 1-benzyl pyrrolidine-3-carboxylate, A8193, 214603-97-1,

Complexity	249
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.142g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	233.311g/mol
Monoisotopic Mass	233.142g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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