AG00CLAU

32454-33-4 | 2-(3-Methoxy-phenyl)-2-methyl-propionic acid methyl ester

AG00CLAU

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CAS Number	32454-33-4
Catalog Number	AG00CLAU(AGN-PC-0R7RTX)
Chemical Name	2-(3-Methoxy-phenyl)-2-methyl-propionic acid methyl ester
IUPAC Name	methyl 2-(3-methoxyphenyl)-2-methylpropanoate
InChI	InChI=1S/C12H16O3/c1-12(2,11(13)15-4)9-6-5-7-10(8-9)14-3/h5-8H,1-4H3
InChI Key	FVSBGHWTPTUGCQ-UHFFFAOYSA-N
MDL Number	MFCD19441874
Molecular Formula	C12H16O3
Molecular Weight	208.2536
SMILES	CC(C)(C1=CC=CC(OC)=C1)C(OC)=O
Synonyms	Methyl 2-(3-methoxyphenyl)-2-methylpropanoate, 32454-33-4, 2-(3-Methoxy-phenyl)-2-methyl-propionic acid methyl ester, SCHEMBL3507981, CTK7A8876, KS-00000OMW, DTXSID50619383, FVSBGHWTPTUGCQ-UHFFFAOYSA-N, MFCD19441874, ZINC71863882, AKOS015995163, RP26422, AK-48149, DS-14565, AB0077574, AJ-118802, 4CH-022306, ST24047612, methyl 2-(3-methoxyphenyl)-2-methylpropionate, Z-8316, 2-(3-Methoxyphenyl)isobutyric acid methyl ester,

Complexity	223
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.11g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	208.257g/mol
Monoisotopic Mass	208.11g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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