AG00AM5S

193819-51-1 | 6-(Hydroxymethyl)-1-indanone

AG00AM5S

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CAS Number	193819-51-1
Catalog Number	AG00AM5S(AGN-PC-037NFH)
Chemical Name	6-(Hydroxymethyl)-1-indanone
IUPAC Name	6-(hydroxymethyl)-2,3-dihydroinden-1-one
InChI	InChI=1S/C10H10O2/c11-6-7-1-2-8-3-4-10(12)9(8)5-7/h1-2,5,11H,3-4,6H2
InChI Key	DFJWZRFJYGQPEA-UHFFFAOYSA-N
MDL Number	MFCD18207615
Molecular Formula	C10H10O2
Molecular Weight	162.1852
SMILES	O=C1CCC2=C1C=C(CO)C=C2
Synonyms	193819-51-1, 6-(Hydroxymethyl)-2,3-dihydro-1H-inden-1-one, 6-HYDROXYMETHYL-1-INDANONE, 1H-Inden-1-one, 2,3-dihydro-6-(hydroxymethyl)-, AK138387, 6-(Hydroxymethyl)-1-indanone, SCHEMBL4818350, CTK4E1359, DTXSID80610949, DFJWZRFJYGQPEA-UHFFFAOYSA-N, MFCD18207615, ZINC90727983, AKOS022173867, FCH1154209, AJ-129170, AX8259990, 1H-Inden-1-one,2,3-dihydro-6-(hydroxymethyl)-,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.068g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	162.188g/mol
Monoisotopic Mass	162.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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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