CAS 2785-76-4 | 1,2-Benzenediol, 3,4-dimethyl- | CAS Number 2785-76-4

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2785-76-4 | 1,2-Benzenediol, 3,4-dimethyl-

CAS No: 2785-76-4 Catalog No: AG002UXO MDL No:MFCD24713562

Product Description

Catalog Number:

AG002UXO

Chemical Name:

1,2-Benzenediol, 3,4-dimethyl-

CAS Number:

2785-76-4

Molecular Formula:

C8H10O2

Molecular Weight:

138.1638

MDL Number:

MFCD24713562

IUPAC Name:

3,4-dimethylbenzene-1,2-diol

InChI:

InChI=1S/C8H10O2/c1-5-3-4-7(9)8(10)6(5)2/h3-4,9-10H,1-2H3

InChI Key:

RYHGQTREHREIBC-UHFFFAOYSA-N

SMILES:

Cc1ccc(c(c1C)O)O

Properties

Complexity:

114

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

138.068g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

138.166g/mol

Monoisotopic Mass:

138.068g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9

Literature

Title	Journal
The role of residue Thr249 in modulating the catalytic efficiency and substrate specificity of catechol-2,3-dioxygenase from Pseudomonas stutzeri OX1.	The FEBS journal 20060701
Isolation and characterization of a rhodococcus species strain able to grow on ortho- and para-xylene.	Journal of microbiology (Seoul, Korea) 20050801
Functional characterization and molecular modeling of methylcatechol 2,3-dioxygenase from o-xylene-degrading Rhodococcus sp. strain DK17.	Biochemical and biophysical research communications 20050128
Synthesis of chlorinated and non-chlorinated biphenyl-2,3- and 3,4-catechols and their [2H3]-isotopomers.	Organic & biomolecular chemistry 20040921
Characterization of Rhodococcus opacus R7, a strain able to degrade naphthalene and o-xylene isolated from a polycyclic aromatic hydrocarbon-contaminated soil.	Research in microbiology 20010901