AG003O3M

19444-23-6 | Benzyl 2-hydroxy-2-methylpropanoate

AG003O3M

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CAS Number	19444-23-6
Catalog Number	AG003O3M(AGN-PC-0O6GRT)
Chemical Name	Benzyl 2-hydroxy-2-methylpropanoate
IUPAC Name	benzyl 2-hydroxy-2-methylpropanoate
InChI	InChI=1S/C11H14O3/c1-11(2,13)10(12)14-8-9-6-4-3-5-7-9/h3-7,13H,8H2,1-2H3
InChI Key	KLUBEEQODOBJQB-UHFFFAOYSA-N
MDL Number	MFCD21641337
Molecular Formula	C11H14O3
Molecular Weight	194.2271
SMILES	CC(C)(O)C(OCC1=CC=CC=C1)=O
Synonyms	Benzyl 2-hydroxy-2-methylpropanoate, 19444-23-6, Benzyl 2-Hydroxy-2-methylpropionate, Propanoic acid, 2-hydroxy-2-methyl-, phenylmethyl ester, Benzyl 2-hydroxyisobutyrate, SCHEMBL3756497, CTK0E1084, DTXSID70552344, KLUBEEQODOBJQB-UHFFFAOYSA-N, Benzyl2-Hydroxy-2-methylpropionate, KS-000008ZT, 6533AJ, MFCD21641337, ZINC34185388, 2-Hydroxyisobutyric acid benzyl ester, AKOS022184120, TRA0018723, AJ-87362, AK-85827, CJ-18233, DA-18012, DS-18112, SY018846, AB0063121, TC-308069, CS-0060866, FT-0710184, K-5732, MFCD21641337 (97+%), C11H14O3, ACN-052958, 10203-58-4,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.094g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	194.23g/mol
Monoisotopic Mass	194.094g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number