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p-tert-Butoxybenzaldehyde

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Catalog Number

ACM57699453

Product Name

Structure

CAS

57699-45-3

Product Overview

Synonyms

Benzaldehyde, 4-(1,1-dimethylethoxy)-; DTXSID10206399; TC-121524; VZ27952; AN-39935; 4-(tert-Butyloxy)benzaldehyde; W-105448; ANW-32779; SCHEMBL387263; CJ-33462;

IUPAC Name

4-[(2-methylpropan-2-yl)oxy]benzaldehyde;

Molecular Weight

178.231g/mol

Molecular Formula

C11H14O2;

Canonical SMILES

CC(C)(C)OC1=CC=C(C=C1)C=O;

InChI

InChI=1S/C11H14O2/c1-11(2,3)13-10-6-4-9(8-12)5-7-10/h4-8H,1-3H3;

InChI Key

VWSFZYXXQDKXKQ-UHFFFAOYSA-N;

Complexity

161

Covalently-Bonded Unit Count

EC Number

260-909-5

Exact Mass

178.099g/mol

H-Bond Acceptor

Heavy Atom Count

Monoisotopic Mass

178.099g/mol

Rotatable Bond Count

Topological Polar Surface Area

26.3A^2

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