2-tert-Butoxybenzaldehyde - CAS 35129-22-7

Catalog:	BB022486
Product Name:	2-tert-Butoxybenzaldehyde
CAS:	35129-22-7
Synonyms:	2-[(2-methylpropan-2-yl)oxy]benzaldehyde; 2-[(2-methylpropan-2-yl)oxy]benzaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	2-[(2-methylpropan-2-yl)oxy]benzaldehyde
Description:	2-tert-Butoxybenzaldehyde (CAS# 35129-22-7) is a useful research chemical.
Molecular Weight:	178.23
Molecular Formula:	C11H14O2
Canonical SMILES:	CC(C)(C)OC1=CC=CC=C1C=O
InChI:	InChI=1S/C11H14O2/c1-11(2,3)13-10-7-5-4-6-9(10)8-12/h4-8H,1-3H3
InChI Key:	NAGSWLQWNWNACQ-UHFFFAOYSA-N
Appearance:	Liquid
LogP:	2.67640

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]
Chloranilic acid
[1427004-19-0]
DBCO-PEG4-NHS ester
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

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Complexity:	169
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	178.099379685
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	178.099379685
Rotatable Bond Count:	3
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7