AG003Q99

80518-57-6 | Ethyl 4-(piperazin-1-yl)benzoate

AG003Q99

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	80518-57-6
Catalog Number	AG003Q99(AGN-PC-0KKOGS)
Chemical Name	Ethyl 4-(piperazin-1-yl)benzoate
IUPAC Name	ethyl 4-piperazin-1-ylbenzoate
InChI	InChI=1S/C13H18N2O2/c1-2-17-13(16)11-3-5-12(6-4-11)15-9-7-14-8-10-15/h3-6,14H,2,7-10H2,1H3
InChI Key	OQEHTFFLOHTFSB-UHFFFAOYSA-N
MDL Number	MFCD04973340
Molecular Formula	C13H18N2O2
Molecular Weight	234.2942
SMILES	C(=O)(OCC)c1ccc(cc1)N1CCNCC1
Synonyms	80518-57-6, ethyl 4-(piperazin-1-yl)benzoate, ethyl 4-(1-piperazinyl)benzoate, 4-(Piperazin-1-yl)-benzoic acid ethyl ester, Ethyl 4-piperazin-1-ylbenzoate, ethyl 4-(1-piperazino)benzoate, 1-(4-ethoxycarbonylphenyl)piperazine, Benzoic acid, 4-(1-piperazinyl)-, ethyl ester, 4-(1-piperazinyl)benzoic acid ethyl ester, 4-piperazin-1-yl-benzoic acid ethyl ester, ethyl 4-(piperazin-1yl)benzoate, MFCD04973340, 4-(Piperazin-1-yl)benzoic acidethylester, Ethyl4-(1-piperazinyl)benzoate, PubChem12242, AC1MC4CW, ethyl 4-piperazinylbenzoate, SCHEMBL62795, ethyl 4-(piperazinyl)benzoate, CTK5E7865, ethyl 4-piperazin-1-yl-benzoate, DTXSID00375604, 1-(4-carbethoxyphenyl)-piperazin, OQEHTFFLOHTFSB-UHFFFAOYSA-N, KS-000029WF, STR06887, ZINC2540616, ZX-AT007548, 4-Piperazinobenzoic acid ethyl ester, Ethyl 4-(piperazin-1-yl)-benzoate, 4-piperazinylbenzoic acid ethyl ester, ANW-59948, KM2037, OR0944, AKOS015947690, MCULE-7459121169, PS-3243, RP28128, TRA0058763, AJ-39104, AK-29545, AN-25478, AX8091558, TC-148693, 4CH-021606, A9957, E1260, FT-0604288, FT-0703897, ST24047000, 4-(1-piperazinyl)-benzoic acid, ethyl ester, 4-(piperazine-1-yl)-benzoic acid ethyl ester, Ethyl 4-(1-piperazinyl)benzoate, AldrichCPR, J3.520.603E, 4-(1-piperazinyl)- benzoic acid, ethyl ester, Benzoic acid,4-(1-piperazinyl)-, ethyl ester, 4-(PIPERAZIN-1-YL)-BENZOICACIDETHYLESTER, 518P576, 4-(piperazin-1-yl)-benzoic acid ethyl ester >98%, J-513818, 4 - (Piperazin - 1 - yl) - benzoic acid ethyl ester, 4- -BENZOICACIDETHYLESTER, ACN-052745, CID2761178, 4-(Piperazin-1-yl)-benzoic acid ethyl ester, 98% - 10G 10g,

Complexity	244
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	234.137g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	234.299g/mol
Monoisotopic Mass	234.137g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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

Lot Number