4'-tert-Butylacetanilide

C₁₂H₁₇NOCAS 20330-45-4191.27 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₇NO
Molar mass: 191.27 g/mol
Exact mass: 191.1310 Da
logP: 2.94Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

20330-45-4

SMILES

CC(=O)NC1=CC=C(C=C1)C(C)(C)C

InChIKey

RMUYDDKCUZHVHY-UHFFFAOYSA-N

InChI

InChI=1S/C12H17NO/c1-9(14)13-11-7-5-10(6-8-11)12(2,3)4/h5-8H,1-4H3,(H,13,14)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

4'-(tert-Butyl)acetanilide

Work with 4'-tert-Butylacetanilide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4′-tert-Butylacetophenone943-27-148 % similar 4-tert-Butylphenylhydrazine hydrochloride128231-55-044 % similar 4-tert-Butylbenzohydrazide43100-38-543 % similar 4-tert-Butylbenzoyl chloride1710-98-143 % similar Para-tert-butylbenzoic acid98-73-743 % similar 1-tert-Butyl-4-iodobenzene35779-04-542 % similar 4-tert-Butylbenzophenone22679-54-542 % similar 4,4′-Bis(1,1-dimethylethyl)-1,1′-biphenyl1625-91-841 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Deet134-62-3 1-Benzyl-3-hydroxypiperidine14813-01-5 1-Benzyl-4-hydroxypiperidine4727-72-4 4-(Phenylmethyl)-4-piperidinol51135-96-7 Butylacetanilide91-49-6 (3R)-1-(Phenylmethyl)-3-piperidinol91599-81-4 4-(Diethylamino)-2-methylbenzaldehyde92-14-8

Elsewhere

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