AG008NJK

77242-30-9 | BENZENEMETHANOL,2-AMINO-5-NITRO-

AG008NJK

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CAS Number	77242-30-9
Catalog Number	AG008NJK(AGN-PC-0UB9TI)
Chemical Name	BENZENEMETHANOL,2-AMINO-5-NITRO-
EC Number	278-645-4
IUPAC Name	(2-amino-5-nitrophenyl)methanol
InChI	InChI=1S/C7H8N2O3/c8-7-2-1-6(9(11)12)3-5(7)4-10/h1-3,10H,4,8H2
InChI Key	XEALBFKUNCXFTO-UHFFFAOYSA-N
MDL Number	MFCD09834918
Molecular Formula	C7H8N2O3
Molecular Weight	168.1500
SMILES	O=[N+](C1=CC=C(N)C(CO)=C1)[O-]
Synonyms	77242-30-9, (2-amino-5-nitrophenyl)methanol, 2-Amino-5-nitrobenzyl alcohol, (2-amino-5-nitro-phenyl)-methanol, Benzenemethanol,2-amino-5-nitro-, EINECS 278-645-4, AC1MI71S, AC1Q51YK, 2-Hydroxymethyl-4-Nitroaniline, SCHEMBL1922592, CTK5E4076, XEALBFKUNCXFTO-UHFFFAOYSA-N, Benzenemethanol, 2-amino-5-nitro-, ZINC33606697, AKOS011475507, AB52850, NS-01357, SY096677, CS-0045318, MFCD09834918 (95%), Z-8921, C7-H8-N2-O3, CID3018706, 78468-34-5,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	168.152g/mol
Monoisotopic Mass	168.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	92.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H411
Packing Group	Ⅲ
Precautionary statements	P273
UN Code	UN 3077

Certificate of Analysis

Lot Number