AG0038ST

33414-49-2 | 1-(3-Hydroxy-4-methylphenyl)ethanone

AG0038ST

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CAS Number	33414-49-2
Catalog Number	AG0038ST(AGN-PC-0NICSN)
Chemical Name	1-(3-Hydroxy-4-methylphenyl)ethanone
IUPAC Name	1-(3-hydroxy-4-methylphenyl)ethanone
InChI	InChI=1S/C9H10O2/c1-6-3-4-8(7(2)10)5-9(6)11/h3-5,11H,1-2H3
InChI Key	MFJCFSDSJMSMQK-UHFFFAOYSA-N
MDL Number	MFCD06658171
Molecular Formula	C9H10O2
Molecular Weight	150.1745
SMILES	OC=1C=C(C=CC1C)C(C)=O
Synonyms	1-(3-Hydroxy-4-methylphenyl)ethanone, 33414-49-2, 3'-HYDROXY-4'-METHYLACETOPHENONE, 3-hydroxy-4-methylacetophenone, Ethanone, 1-(3-hydroxy-4-methylphenyl)-, PubChem24105, 5-acetyl-2-methylphenol, KSC218I8J, SCHEMBL1550819, CTK1B8484, DTXSID60484084, ABLOCK AB-10-3888, MFJCFSDSJMSMQK-UHFFFAOYSA-N, ACT00882, ANW-45457, CL8658, FCH853088, MFCD06658171, ZINC14488646, AKOS006294851, AS05196, AJ-64881, AK-67829, AS-46066, CJ-14546, AB0024274, AX8011242, DB-048622, TC-134202, FT-0639190, FT-0686379, ST24026880, W5512, KS-00001069, X-1352, 1-(3-HYDROXY-4-METHYLPHENYL)ETHAN-1-ONE, I01-6656, C9H10O2,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.068g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	150.177g/mol
Monoisotopic Mass	150.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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