AG006CTW

93841-25-9 | 2-(2,5-Diaminophenyl)ethanol sulfate

AG006CTW

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CAS Number	93841-25-9
Catalog Number	AG006CTW(AGN-PC-0W3FSW)
Chemical Name	2-(2,5-Diaminophenyl)ethanol sulfate
EC Number	298-995-1
IUPAC Name	2-(2,5-diaminophenyl)ethanol;sulfuric acid
InChI	InChI=1S/C8H12N2O.H2O4S/c9-7-1-2-8(10)6(5-7)3-4-11;1-5(2,3)4/h1-2,5,11H,3-4,9-10H2;(H2,1,2,3,4)
InChI Key	VBSLNFWECRRALP-UHFFFAOYSA-N
MDL Number	MFCD08458357
Molecular Formula	C8H14N2O5S
Molecular Weight	250.2722
SMILES	NC1=CC=C(N)C(CCO)=C1.O=S(O)(O)=O
UNII	L8W90PN89R
Synonyms	2-(2,5-Diaminophenyl)ethanol sulfate, 93841-25-9, 2-(2-Hydroxy)ethyl-p-phenylene diamino sulfate, 2,5-Diaminophenylethanol sulfate, AK-93486, 2-(2,5-diaminophenyl)ethan-1-ol; sulfuric acid, W-100226, PubChem20871, KSC914E4H, SCHEMBL672183, 2,5-diaminophenylethanolsulfate, benzeneethanol, 2,5-diamino-, sulfate (1:1) (salt), 2-(2-hydroxy)ethyl-p-phenylene, CTK8B4243, ANW-44487, MFCD08458357, AKOS015897347, AC-8153, CS-W005418, DS-2057, Hydroxyethyl-p-phenylenediamine sulphate, MP-0819, KS-000011N3, BC209154, SC-16118, AB0069000, AX8023184, ST2409267, TR-029349, FT-0652704, 2-(2,5-diaminophenyl)ethanol; sulfuric acid, 2-[2,5-bis(azanyl)phenyl]ethanol; sulfuric acid, 841H259, A844718, C-35442, I09-0484, I14-6492, hydroxyethyl-p-phenylenediaminesulfatephenylenediaminesulfate(2,5-diaminophenylethanolsulfate), UNII-L8W90PN89R, Hydroxyethyl-p-phenylenediamine sulfate, C8H12N2O.H2O4S, L8W90PN89R, ACN-S005394, EINECS 298-995-1, 2-(2,5-Diaminophenyl)ethanolsulfate, C8-H12-N2-O.H2-O4-S, 3-(2-Hydroxyethyl)-p-phenylenediammonium sulphate,

Complexity	200
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	250.062g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	250.269g/mol
Monoisotopic Mass	250.062g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	155A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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