AG003UVV

2815-34-1 | trans-2,5-Dimethylpiperazine

AG003UVV

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CAS Number	2815-34-1
Catalog Number	AG003UVV(AGN-PC-0R3P1O)
Chemical Name	trans-2,5-Dimethylpiperazine
IUPAC Name	(2R,5S)-2,5-dimethylpiperazine
InChI	InChI=1S/C6H14N2/c1-5-3-8-6(2)4-7-5/h5-8H,3-4H2,1-2H3/t5-,6+
InChI Key	NSMWYRLQHIXVAP-OLQVQODUSA-N
MDL Number	MFCD00070516
Molecular Formula	C6H14N2
Molecular Weight	114.1888
NSC Number	3708
SMILES	C[C@@H]1NC[C@@H](C)NC1
UNII	R1QQJ26FS6
Synonyms	trans-2,5-Dimethylpiperazine, 2815-34-1, (2R,5S)-2,5-dimethylpiperazine, (2S,5R)-2,5-Dimethylpiperazine, MFCD00070516, NSMWYRLQHIXVAP-OLQVQODUSA-N, Piperazine, 2,5-dimethyl-, (2R,5S)-rel-, UNII-R1QQJ26FS6, R1QQJ26FS6, (2r,5s)-2,5-dimethylpiperazin, NSC3708, Piperazine, 2,5-dimethyl-, trans-, (2R,5S)-2,5-DIMETHYL-PIPERAZINE, PubChem15878, (2S,5R)-2,5-DIMETHYL-PIPERAZINE, 2,5-Dimethylpiperazine #, trans-2,5 dimethylpiperazine, SCHEMBL101769, trans-2,5-dimethyl piperazine, trans-2,5-Dimethyl-piperazine, 2alpha,5beta-Dimethylpiperazine, AC1L595O, AC1Q4W02, Jsp005420, (trans)-2,5-dimethylpiperazine, Piperazine,5-dimethyl-, trans-, CTK3J4559, KS-00000DMO, CS-B1271, NSC-3708, (2S, 5R)-2,5-dimethylpiperazine, AC-371, ANW-26339, CX1379, FCH950112, trans-2,5-Dimethylpiperazine, 98%, ZINC84317011, (+/-)-trans-2,5-dimethylpiperazine, AKOS006349671, AB02818, ACN-001796, RTR-032429, AN-15911, AS-11849, BC209523, BP-11311, BR-25702, SC-13269, AB0010869, AX8019941, DB-016197, ST2414001, TL8002239, TR-032429, AM20090356, D0763, FT-0634502, EN300-86239, M-3578, 32914-EP2301933A1, 32914-EP2311827A1, 815D341, A819349, J-001612, J-016991, UNII-ZIZ1G1N25S component NSMWYRLQHIXVAP-OLQVQODUSA-N, InChI=1/C6H14N2/c1-5-3-8-6(2)4-7-5/h5-8H,3-4H2,1-2H3/t5-,6, 2,5-DIMETHYLPIPERAZINE, 1,4-Dimethylpiperazine, 2,5-Dimethylpiperazine (trans), C6H14N2, KST-1A3950, AR-1A3050, CID220672, CB10128, trans-2,5-Dimethylpiperazine, 98% - 1G 1g, 33872-54-7, 1119702-25-8,

Complexity	62.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	114.116g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	114.192g/mol
Monoisotopic Mass	114.116g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	24.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	4.1(6.1)
Hazard statements	H228-H303-H311-H315-H319
Packing Group	Ⅱ
Precautionary statements	P210-P240-P241-P264-P280-P302+P352+P312+P361+P364-P305+P351+P338+P337+P313-P312-P405-P501
UN Code	UN 2926

Certificate of Analysis

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