AG002W7I

2871-01-4 | Ethanol, 2-[(4-amino-2-nitrophenyl)amino]-

AG002W7I

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CAS Number	2871-01-4
Catalog Number	AG002W7I(AGN-PC-0KUVGP)
Chemical Name	Ethanol, 2-[(4-amino-2-nitrophenyl)amino]-
EC Number	220-701-7
IUPAC Name	2-(4-amino-2-nitroanilino)ethanol
InChI	InChI=1S/C8H11N3O3/c9-6-1-2-7(10-3-4-12)8(5-6)11(13)14/h1-2,5,10,12H,3-4,9H2
InChI Key	GZGZVOLBULPDFD-UHFFFAOYSA-N
MDL Number	MFCD00071801
Molecular Formula	C8H11N3O3
Molecular Weight	197.1912
SMILES	O=[N+](C1=CC(N)=CC=C1NCCO)[O-]
UNII	51CPX7M1SQ
Synonyms	2-((4-amino-2-nitrophenyl)amino)ethanol, HC Red No. 3, 2871-01-4, 2-((4-Amino-2-nitrophenyl)amino)ethanol, HC Red 3, 2-(4-amino-2-nitroanilino)-ethanol, HC Red No. 3, 2-(4-Amino-2-nitroanilino)ethanol, UNII-51CPX7M1SQ, H.C. Red 3, 51CPX7M1SQ, HC RED #3, 2-[(4-amino-2-nitrophenyl)amino]ethanol, CCRIS 1363, CHEBI:82473, Ethanol, 2-[(4-amino-2-nitrophenyl)amino]-, HSDB 4203, NCI-C54922, EINECS 220-701-7, BRN 2110120, 4-(2-Hydroxyethyl)amino-3-nitroaniline, Ethanol, 2-(4-amino-2-nitroanilino)-, 4-amino-2-nitro-n-(2-hydroxyethyl)aniline, Ethanol, 2-((4-amino-2-nitrophenyl)amino)-, N1-(2-Hydroxyethyl)-2-nitro-p-phenylenediamine, N(sup 1)-(2-Hydroxyethyl)-2-nitro-p-phenylenediamine, HC Red No.3, AC1MRC2L, DSSTox_CID_1236, DSSTox_RID_76028, DSSTox_GSID_21236, SCHEMBL109433, CHEMBL3185903, DTXSID2021236, CTK1A1891, ZINC6423774, Tox21_302416, ANW-44490, MFCD00071801, 2-(4-amino-2-nitro-anilino)ethanol, AKOS006274887, 2-(4-amino-2-nitrophenylamino)ethanol, AC-8702, AM84888, AN-7753, LS-1133, LS10709, VZ32328, 4-amino-2-nitro-n-hydroxyethyl aniline, NCGC00255317-01, AJ-56183, CAS-2871-01-4, 2-[(4-Amino-2-nitrophenyl)amino]-ethanol, 4-Amino-N-(2-hydroxyethyl)-2-nitroaniline, AB1008671, DB-047437, ST2409238, TC-133235, 2-[(4-azanyl-2-nitro-phenyl)amino]ethanol, FT-0629654, C19430, N-(2-hydroxyethyl)-2-nitro-p-phenylenediamine, 871A014, A819545, I01-3563, N1-(2-Hydroxyethyl)-2-nitro-1,4-phenylenediamine, null, 2- -ETHANOL, C8H11N3O3, CID3465817, R282, A2671,

Complexity	195
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.08g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	197.194g/mol
Monoisotopic Mass	197.08g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P261-P280
UN Code

Certificate of Analysis

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