AG003SNK

4067-16-7 | Pentaethylenehexamine

AG003SNK

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CAS Number	4067-16-7
Catalog Number	AG003SNK(AGN-PC-0JKF0G)
Chemical Name	Pentaethylenehexamine
EC Number	223-775-9
IUPAC Name	N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine
InChI	InChI=1S/C10H28N6/c11-1-3-13-5-7-15-9-10-16-8-6-14-4-2-12/h13-16H,1-12H2
InChI Key	LSHROXHEILXKHM-UHFFFAOYSA-N
MDL Number	MFCD00008167
Molecular Formula	C10H28N6
Molecular Weight	232.3695
SMILES	NCCNCCNCCNCCNCCN
UN Number	2735
UNII	9K5VZU43LE
Synonyms	PENTAEN, pentaethylenehexamine, pentaethylenehexamine hexahydrochloride, PENTAETHYLENEHEXAMINE, 4067-16-7, PEHA, 3,6,9,12-Tetraazatetradecane-1,14-diamine, 3,6,9,12-Tetraazatetradecamethylenediamine, N1,N1'-(Ethane-1,2-diyl)bis(N2-(2-aminoethyl)ethane-1,2-diamine), UNII-9K5VZU43LE, CCRIS 6264, EINECS 223-775-9, BRN 1768042, 9K5VZU43LE, LSHROXHEILXKHM-UHFFFAOYSA-N, W-109943, N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine, Pentaethylenexamine, pentaethylene hexamine, AC1L2FAT, ACMC-209u0m, EC 223-775-9, AC1Q54MS, SCHEMBL26707, CHEMBL65184, DTXSID7025843, CTK1D7223, KS-00000ULV, ANW-43172, LS-110, MFCD00008167, ZINC22465713, Pentaethylenehexamine, technical grade, AKOS024462522, AJ-81395, AK161733, CC-33539, DB-026856, RT-001616, FT-0635115, P0622, Pentaethylenehexamine, many component mixture, ST24048688, 1,14-diamino-3,6,9,12-tetraazatetradecane, C-31297, N,N'-bis[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine, N1,N1-(Ethane-1,2-diyl)bis(N2-(2-aminoethyl)ethane-1,2-diamine), N1,N1'-(Ethane-1,2-diyl);bis(N2-(2-aminoethyl);ethane-1,2-diamine);, PEN (CHRIS Code), C10H28N6, CID19990, Pentaethylenehexamine (Peha) 250ml, C10-H28-N6, 4-04-00-01245 (Beilstein Handbook Reference),

Complexity	108
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.238g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	6
Isotope Atom Count	0
Molecular Weight	232.376g/mol
Monoisotopic Mass	232.238g/mol
Rotatable Bond Count	13
Topological Polar Surface Area	100A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302+H312-H314-H317-H410
Packing Group	Ⅲ
Precautionary statements	P273-P280-P305+P351+P338-P310-P501
UN Code	UN 2735

Certificate of Analysis

Lot Number