AG003LMX

41870-24-0 | (4-Methoxy-3-nitrophenyl)methanol

AG003LMX

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CAS Number	41870-24-0
Catalog Number	AG003LMX(AGN-PC-0WBPCY)
Chemical Name	(4-Methoxy-3-nitrophenyl)methanol
IUPAC Name	(4-methoxy-3-nitrophenyl)methanol
InChI	InChI=1S/C8H9NO4/c1-13-8-3-2-6(5-10)4-7(8)9(11)12/h2-4,10H,5H2,1H3
InChI Key	XJVDLGZUYYAXLS-UHFFFAOYSA-N
MDL Number	MFCD02683526
Molecular Formula	C8H9NO4
Molecular Weight	183.1614
SMILES	COC1=C(C=C(CO)C=C1)[N+]([O-])=O
Synonyms	(4-methoxy-3-nitrophenyl)methanol, 41870-24-0, 4-Methoxy-3-nitrobenzyl alcohol, XJVDLGZUYYAXLS-UHFFFAOYSA-N, AC1NATFI, ACMC-20ad63, SCHEMBL1667910, 3-Nitro-4-methoxybenzenemethanol, CTK4I5314, DTXSID10403240, ALBB-014517, ZINC2583611, 5764AB, ANW-67993, Benzenemethanol, 4-methoxy-3-nitro-, MFCD02683526, AKOS005174733, AKOS015913620, 4-Methoxy-3-nitrobenzyl alcohol, 97%, AJ-43259, DA-17935, TC-156738, CS-0063190, FT-0769809, R6081, I14-45616, C8H9NO4, ZINC02583611, CID4432413,

Complexity	180
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.053g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	183.163g/mol
Monoisotopic Mass	183.053g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	75.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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