AG002UXN

2785-78-6 | 1,2-Benzenediol, 3,6-dimethyl-

AG002UXN

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CAS Number	2785-78-6
Catalog Number	AG002UXN(AGN-PC-009QAS)
Chemical Name	1,2-Benzenediol, 3,6-dimethyl-
IUPAC Name	3,6-dimethylbenzene-1,2-diol
InChI	InChI=1S/C8H10O2/c1-5-3-4-6(2)8(10)7(5)9/h3-4,9-10H,1-2H3
InChI Key	RGUZWBOJHNWZOK-UHFFFAOYSA-N
MDL Number	MFCD24713417
Molecular Formula	C8H10O2
Molecular Weight	138.1638
SMILES	OC1=C(C)C=CC(C)=C1O
UNII	I40DP349GK
Synonyms	3,6-dimethylbenzene-1,2-diol, 3,6-Dimethylcatechol, 2785-78-6, 3,6-Dimethylpyrocatechol, 1,2-Benzenediol, 3,6-dimethyl-, UNII-I40DP349GK, I40DP349GK, 1,4-xylenediol, SCHEMBL44351, Pyrocatechol, 3,6-dimethyl-, 2,5-dimethyl-1,6-benzenediol, CTK0J2362, DTXSID00466788, RGUZWBOJHNWZOK-UHFFFAOYSA-N, 1,2-Dihydroxy-3,6-dimethylbenzene, MFCD24713417, ZINC71129833, AKOS027339171, c1346, CID11469114,

Complexity	99.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	138.068g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	138.166g/mol
Monoisotopic Mass	138.068g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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