AG003E8X

87179-40-6 | 1-Cinnamylpiperazine

AG003E8X

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CAS Number	87179-40-6
Catalog Number	AG003E8X(AGN-PC-0OKVFZ)
Chemical Name	1-Cinnamylpiperazine
EC Number	242-652-0
IUPAC Name	1-[(E)-3-phenylprop-2-enyl]piperazine
InChI	InChI=1S/C13H18N2/c1-2-5-13(6-3-1)7-4-10-15-11-8-14-9-12-15/h1-7,14H,8-12H2/b7-4+
InChI Key	WGEIOMTZIIOUMA-QPJJXVBHSA-N
MDL Number	MFCD00063251
Molecular Formula	C13H18N2
Molecular Weight	202.2954
SMILES	N1(C/C=C/C2=CC=CC=C2)CCNCC1
Synonyms	trans-1-Cinnamylpiperazine, 1-Cinnamylpiperazine, 87179-40-6, 18903-01-0, 1-(Cinnamyl)piperazine, N-Cinnamylpiperazine, 1-(3-phenylprop-2-en-1-yl)piperazine, 1-((E)-3-Phenylallyl)piperazine, 1-(cinnamyl)-piperazine, 1-trans-cinnamyl piperazine, 1-(3-phenyl-allyl)-piperazine, 1-[(2E)-3-phenylprop-2-en-1-yl]piperazine, MFCD00063251, ((2E)-3-phenylprop-2-enyl)piperazine, (E)-1-Phenyl-3-(1-piperazinyl)-1-propene, Piperazine, 1-[(2E)-3-phenyl-2-propenyl]-, cinnamylpiperazine, N-cinnamyl piperazine, [(2E)-3-phenylprop-2-enyl]piperazine, 1-[3-Phenylprop-2-en-1-yl]piperazine, 1-(3-phenyl-2-propenyl)piperazine, 1-[(2e)-3-phenylprop-2-en-1-yl]piperazin, 1-cinnamyl piperazine, PubChem8564, AC1LDXG5, timtec-bb sbb000411, AC1Q28ER, AC1Q28IJ, trans-1-cinnamyl-piperazine, Oprea1_749211, labotest-bb lt00233225, AC1Q28H5, CHEMBL503140, SCHEMBL1151817, trans-1-Cinnamylpiperazine, 97%, WGEIOMTZIIOUMA-QPJJXVBHSA-N, HMS1540K11, BB_SC-05562, BCP12167, 1-((e)-3-phenyl-allyl)-piperazine, BBL010314, SBB000411, STK374842, ZINC19203144, AKOS000120479, GF-0118, ACM18903010, 1-[(E)-3-phenylprop-2-enyl]piperazine, AC-15888, AJ-72563, SC-46301, ST028630, AX8154599, BB0295279, DB-030453, TL8001538, TR-027286, Piperazine, 1-(3-phenyl-2-propen-1-yl)-, M-2210, AK-968/40723571, F2190-0513, TimTec1_002343, KST-1B1360, KST-1B9027, C13H18N2, EINECS 242-652-0, AR-1B1588, AR-1B8592, CID726896, ACN-048333, C13-H18-N2, propan-2-yl N-(3,4-diethoxyphenyl)carbamate, 1929-56-2, 88619-01-6, 460-00-4,

Complexity	189
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	202.147g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	202.301g/mol
Monoisotopic Mass	202.147g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	15.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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