AG003DRU

34824-20-9 | 1,8-BIS(HYDROXYMETHYL)ANTHRACENE

AG003DRU

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CAS Number	34824-20-9
Catalog Number	AG003DRU(AGN-PC-00KAVX)
Chemical Name	1,8-BIS(HYDROXYMETHYL)ANTHRACENE
IUPAC Name	[8-(hydroxymethyl)anthracen-1-yl]methanol
InChI	InChI=1S/C16H14O2/c17-9-13-5-1-3-11-7-12-4-2-6-14(10-18)16(12)8-15(11)13/h1-8,17-18H,9-10H2
InChI Key	GSHJWFSWKUADLL-UHFFFAOYSA-N
MDL Number	MFCD01321137
Molecular Formula	C16H14O2
Molecular Weight	238.2812
SMILES	OCC1=CC=CC2=CC3=CC=CC(CO)=C3C=C12
Synonyms	1,8-bis(hydroxymethyl)anthracene, anthracene-1,8-dimethanol, 1,8-Bis(hydroxymethyl)anthracene, 34824-20-9, Anthracene-1,8-diyldimethanol, 1,8-Anthracenedimethanol, ACMC-1AEW9, Anthracene-1,8-dimethanol, SCHEMBL1826097, CTK1C1006, (Anthracene-1,8-diyl)dimethanol, DTXSID50514208, GSHJWFSWKUADLL-UHFFFAOYSA-N, 1,8-bis-(Hydroxymethyl)anthracene, ZINC2379575, ANW-27979, MFCD01321137, AKOS015856561, [8-(hydroxymethyl)anthracen-1-yl]methanol, TR-014389, I14-56078, B1904,

Complexity	252
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	238.099g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	238.286g/mol
Monoisotopic Mass	238.099g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number