4,5-Dimethoxy-2-nitrobenzyl alcohol - CAS 1016-58-6

Catalog:	BB000584
Product Name:	4,5-Dimethoxy-2-nitrobenzyl alcohol
CAS:	1016-58-6
Synonyms:	(4,5-dimethoxy-2-nitrophenyl)methanol

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	(4,5-dimethoxy-2-nitrophenyl)methanol
Description:	4,5-Dimethoxy-2-nitrobenzyl alcohol (CAS# 1016-58-6) is a useful research chemical.
Molecular Weight:	213.19
Molecular Formula:	C9H11NO5
Canonical SMILES:	COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OC
InChI:	InChI=1S/C9H11NO5/c1-14-8-3-6(5-11)7(10(12)13)4-9(8)15-2/h3-4,11H,5H2,1-2H3
InChI Key:	WBSCOJBVYHQOFB-UHFFFAOYSA-N
Boiling Point:	383.9 ℃ at 760 mmHg
Purity:	98.0+ %
Density:	1.307 g/cm³
Appearance:	White to light yellow crystal powde
Storage:	Keep in dark place, Sealed in dry, Room Temperature
MDL:	MFCD00014701
LogP:	1.62750

Publication Number	Title	Priority Date
CN-112661691-A	O-nitroacetophenol derivative and preparation method and application thereof	20201231
CN-110590877-A	Linker, drug-loaded linker, cell-penetrating peptide conjugate drug, antibody conjugate drug, and method for producing same	20190813
CN-110590877-B	Linker, drug-loaded linker, cell-penetrating peptide conjugate drug, antibody conjugate drug, and method for producing same	20190813
RU-2709620-C1	Aqueous emulsion based on dimethoxynitrobenzyl esters of arachidonic acid	20190701
KR-102159181-B1	Composition and preparation for photoactivatable fluorescent probes	20190104

PMID	Publication Date	Title	Journal
16189558	20051001	Effects of 4,5-dimethoxy groups on the time-resolved photoconversion of 2-nitrobenzyl alcohols and 2-nitrobenzaldehyde into nitroso derivatives	Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology

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Related Functional Groups

Oxygen Compounds

[77987-49-6]
Z-Glycinol
[1053656-74-8]
10-(2-Tetrahydropyranyloxy)-8-decynoic acid
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[56517-33-0]
2-Bromo-4-isopropoxy-5-methoxybenzaldehyde
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid

Complexity:	217
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	213.06372245
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	213.06372245
Rotatable Bond Count:	3
Topological Polar Surface Area:	84.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8