CAS 7509-11-7 | 4,5-DIMETHOXY-2-NITROTOLUENE | CAS Number 7509-11-7

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7509-11-7 | 4,5-DIMETHOXY-2-NITROTOLUENE

CAS No: 7509-11-7 Catalog No: AG00G36V MDL No:MFCD00060708

Product Description

Catalog Number:

AG00G36V

Chemical Name:

4,5-DIMETHOXY-2-NITROTOLUENE

CAS Number:

7509-11-7

Molecular Formula:

C9H11NO4

Molecular Weight:

197.1879

MDL Number:

MFCD00060708

IUPAC Name:

1,2-dimethoxy-4-methyl-5-nitrobenzene

InChI:

InChI=1S/C9H11NO4/c1-6-4-8(13-2)9(14-3)5-7(6)10(11)12/h4-5H,1-3H3

InChI Key:

BNJRARLHTLUQCH-UHFFFAOYSA-N

SMILES:

COc1cc([N+](=O)[O-])c(cc1OC)C

Properties

Complexity:

204

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

197.19g/mol

Monoisotopic Mass:

197.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
Long conjugated 2-nitrobenzyl derivative caged anticancer prodrugs with visible light regulated release: preparation and functionalizations.	Organic & biomolecular chemistry 20120721
Understanding the relationship between photolysis efficiency and metal binding using ArgenCast photocages.	Photochemistry and photobiology 20120101
Peptide release upon photoconversion of 2-nitrobenzyl compounds into nitroso derivatives.	Photochemistry and photobiology 20110101
Photolytic control and infrared probing of amide I mode in the dipeptide backbone-caged with the 4,5-dimethoxy-2-nitrobenzyl group.	The journal of physical chemistry. B 20080221
Shp2 knockdown and Noonan/LEOPARD mutant Shp2-induced gastrulation defects.	PLoS genetics 20071201
o-nitrobenzyl photolabile protecting groups with red-shifted absorption: syntheses and uncaging cross-sections for one- and two-photon excitation.	Chemistry (Weinheim an der Bergstrasse, Germany) 20060906
Conformational changes during apoplastocyanin folding observed by photocleavable modification and transient grating.	Journal of the American Chemical Society 20060614