AG00EEAZ

62347-97-1 | [4-(Methylamino)-3-nitrophenyl]methanol

AG00EEAZ

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CAS Number	62347-97-1
Catalog Number	AG00EEAZ(AGN-PC-0NIJXU)
Chemical Name	[4-(Methylamino)-3-nitrophenyl]methanol
IUPAC Name	[4-(methylamino)-3-nitrophenyl]methanol
InChI	InChI=1S/C8H10N2O3/c1-9-7-3-2-6(5-11)4-8(7)10(12)13/h2-4,9,11H,5H2,1H3
InChI Key	CQTXKCNAHJKKQU-UHFFFAOYSA-N
MDL Number	MFCD16689902
Molecular Formula	C8H10N2O3
Molecular Weight	182.1766
SMILES	OCC1=CC=C(NC)C([N+]([O-])=O)=C1
Synonyms	[4-(methylamino)-3-nitrophenyl]methanol, 62347-97-1, (4-(Methylamino)-3-nitrophenyl)methanol, SCHEMBL9458424, CTK2C1849, DTXSID70489025, CQTXKCNAHJKKQU-UHFFFAOYSA-N, KS-000029RI, 4-Methylamino-3-nitro-benzylalcohol, MFCD16689902, ZINC39207232, AKOS011475684, MCULE-5721002485, NE-0707, RP10942, N-methyl-4-hydroxymethyl-2-nitroaniline, Benzenemethanol, 4-(methylamino)-3-nitro-, TR-037312, FT-0682731, I05-1970,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.069g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	182.179g/mol
Monoisotopic Mass	182.069g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	78.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319-H317
Packing Group
Precautionary statements	P305+P351+P338-P280
UN Code

Certificate of Analysis

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