AG007W9A

107430-92-2 | 3-(tert-Butyl)-4-methoxybenzaldehyde

AG007W9A

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CAS Number	107430-92-2
Catalog Number	AG007W9A(AGN-PC-0KZVO1)
Chemical Name	3-(tert-Butyl)-4-methoxybenzaldehyde
IUPAC Name	3-tert-butyl-4-methoxybenzaldehyde
InChI	InChI=1S/C12H16O2/c1-12(2,3)10-7-9(8-13)5-6-11(10)14-4/h5-8H,1-4H3
InChI Key	KHDRYKVXOFJZGS-UHFFFAOYSA-N
MDL Number	MFCD01104342
Molecular Formula	C12H16O2
Molecular Weight	192.2542
SMILES	c1(c(ccc(c1)C=O)OC)C(C)(C)C
Synonyms	3-tert-butyl-4-methoxybenzaldehyde, 107430-92-2, 3-(tert-Butyl)-4-methoxybenzaldehyde, AC1MY12T, ARONIS013154, SCHEMBL1547486, CTK4A5428, DTXSID00396253, KHDRYKVXOFJZGS-UHFFFAOYSA-N, ZINC155407, KS-000043VZ, 8411AC, STL068213, AKOS000503842, AS06896, MCULE-8931516659, NCGC00325857-01, AJ-13561, SC-36108, DB-059636, TR-033980, BB 0262271, FT-0681564, ST45049865, Z-1512, AB01320686-02, Benzaldehyde, 3-(1,1-dimethylethyl)-4-methoxy-, I01-13165, C12H16O2, ZINC00155407, CID3774604,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.115g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	192.258g/mol
Monoisotopic Mass	192.115g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H317-H319
Packing Group	\N
Precautionary statements	P305+P351+P338-P280
UN Code	\N

Certificate of Analysis

Lot Number