AG003SAK

4985-85-7 | N-(3-Aminopropyl)diethanolamine

AG003SAK

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CAS Number	4985-85-7
Catalog Number	AG003SAK(AGN-PC-0WBOM9)
Chemical Name	N-(3-Aminopropyl)diethanolamine
EC Number	225-642-0
IUPAC Name	2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol
InChI	InChI=1S/C7H18N2O2/c8-2-1-3-9(4-6-10)5-7-11/h10-11H,1-8H2
InChI Key	FKJVYOFPTRGCSP-UHFFFAOYSA-N
MDL Number	MFCD00047971
Molecular Formula	C7H18N2O2
Molecular Weight	162.2300
NSC Number	8172
SMILES	OCCN(CCCN)CCO
UNII	R21ZI8N14B
Synonyms	N-(3-Aminopropyl)diethanolamine, 4985-85-7, Aminopropyldiethanolamine, (3-Aminopropyl)diethanolamine, Ethanol, 2,2'-[(3-aminopropyl)imino]bis-, 2,2'-[(3-Aminopropyl)imino]diethanol, N,N-Bis(2-hydroxyethyl)-1,3-diaminopropane, UNII-R21ZI8N14B, N,N-Bis(2-hydroxyethyl)-1,3-propanediamine, NSC 8172, Ethanol, 2,2'-(aminopropylimino)-, 2,2'-((3-Aminopropyl)imino)diethanol, N,N-Bis(hydroxyethyl)trimethylenediamine, N,N-Bis(hydroxyethyl)-1,3-propanediamine, N,N-Bis[(hydroxyethyl)trimethylene]diamine, R21ZI8N14B, N,N-Di(2-hydroxyethyl)-1,3-propanediamine, FKJVYOFPTRGCSP-UHFFFAOYSA-N, 2-[(3-Amino-propyl)-(2-hydroxy-ethyl)-amino]-ethanol, 2,2'-(3-aminopropylazanediyl)diethanol, Ethanol, 2,2'-((3-aminopropyl)imino)bis-, 2-[(3-aminopropyl)-(2-hydroxyethyl)amino]-ethanol, 2-[(3-aminopropyl)(2-hydroxyethyl)amino]ethan-1-ol, Aminopropyldiethanolamine (DOT), N-(3-Aminopropyl)iminodiethanol, EINECS 225-642-0, MFCD00047971, PubChem21021, ACMC-209kin, AI3-52554, diethanolamino propylamine, AC1L2HLR, EC 225-642-0, DSSTox_CID_24680, DSSTox_RID_80392, DSSTox_GSID_44680, WLN: Z3N2Q2Q, SCHEMBL352467, CHEMBL3186851, DTXSID2044680, Ethanol,2'-(aminopropylimino)-, CTK3J0440, N-(3-amino-propyl)diethanolamine, n-(3-aminopropyl) diethanolamine, NSC8172, bis(2-hydroxyethyl)aminopropylamine, ALBB-014132, BB_SC-00052, NSC-8172, ZINC1586448, ZX-AN012872, Tox21_301510, 2,2'-(3-Aminopropylimino)diethanol, ANW-30861, BBL009740, SBB010437, STK796823, AKOS000301248, ACM4985857, FS-5382, MCULE-1292608437, RTR-017887, TRA0027111, VZ32919, WT82149, Ethanol,2'-[(3-aminopropyl)imino]di-, KS-000015X3, 3-[bis(2-hydroxyethyl)amino]propylamine, Ethanol,2'-[(3-aminopropyl)imino]bis-, NCGC00256274-01, AK-44853, BAS 00531414, BP-13041, CC-31376, OR322200, 2,2'-((3-aminopropyl)azanediyl)diethanol, CAS-4985-85-7, n n-bis[(hydroxyethyl)trimethylene]diamine, 3-[bis(2-hydroxy-ethyl)amino]-propylamine, AJ-112594, DB-030073, Ethanol, 2,2'-((3-aminopropyl)imino)di-, TR-017887, A1280, FT-0629167, n n-bis(2-hydroxyethyl)-1 3-propanediamine, R1796, ST45028934, X7920, 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol, N1,N1-bis(2-hydroxyethyl)-1,3-propanediamine, 2-[(3-aminopropyl)(2-hydroxyethyl)amino]ethanol, C-04249, Ethanol, 2,2'-((3-aminopropyl)imino)di- (8CI), I05-0327, N,3-propanediamine, C7H18N2O2, CID21088, C7-H18-N2-O2, NA1760, UN1760, Ethanol, 2,2'-[(3-aminopropyl)imino]di-, A7416, Etanol, 2,2'-[(3-aminopropil) imino] bis-,

Complexity	74.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.137g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	162.233g/mol
Monoisotopic Mass	162.137g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	69.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H314
Precuationary statements	P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501
Siginal words

Certificate of Analysis

Lot Number