(4-Hydroxyphenyl)carbamic acid tert-butyl ester

C11H15NO3CAS 54840-15-2209.25 g/mol

Open in Covalent MOL file
OOHNOH
CarbamatePhenol

Properties

Molecular formula
C11H15NO3
Molar mass
209.25 g/mol
Exact mass
209.1052 Da
Melting point
146 °C
logP
2.74Crippen estimate
Polar surface area
58.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
54840-15-2
SMILES
CC(C)(C)OC(=O)Nc1ccc(O)cc1
InChIKey
YRQMBQUMJFVZLF-UHFFFAOYSA-N
InChI
InChI=1S/C11H15NO3/c1-11(2,3)15-10(14)12-8-4-6-9(13)7-5-8/h4-7,13H,1-3H3,(H,12,14)

Weigh it out

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

Names and synonyms

13 names · show all
  • Carbamic acid, N-(4-hydroxyphenyl)-, 1,1-dimethylethyl ester
  • Carbamic acid, (4-hydroxyphenyl)-, 1,1-dimethylethyl ester
  • 4-[(tert-Butoxycarbonyl)amino]phenol
  • tert-Butyl p-hydroxycarbanilate
  • tert-Butyl 4-hydroxyphenylcarbamate
  • tert-Butyl N-(4-hydroxyphenyl)carbamate
  • N-(4-Hydroxyphenyl)carbamic acid tert-butyl ester
  • N-(tert-Butoxycarbonyl)-4-hydroxyaniline
  • 4-(N-t-Butoxycarbonylamino)phenol
  • 1,1-Dimethylethyl (4-hydroxyphenyl)carbamate
  • 4-Hydroxy-N-(tert-butoxycarbonyl)aniline
  • N-Boc-4-hydroxyaniline
  • N-Boc-4-aminophenol

Work with (4-Hydroxyphenyl)carbamic acid tert-butyl ester

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

tert-Butyl N-(4-bromophenyl)-carbamate131818-17-271 % similar t-Butyl carbanilate3422-01-368 % similar tert-Butyl (4-aminophenyl)carbamate71026-66-967 % similar (4-Boc-aminophenyl)boronic acid380430-49-966 % similar Boc-4-abz-oh66493-39-866 % similar 4-(Boc-amino)pyridine98400-69-264 % similar tert-Butyl N-(4-(aminomethyl)phenyl)carbamate220298-96-462 % similar N-Boc-tyramine64318-28-160 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Propoxur114-26-1 Ethyl-4-acetyl-3,5-dimethylpyrrole-2-carboxylate2386-26-7 5-(Piperidin-1-ylmethyl)furan-2-carboxylic acid301353-36-6 Benzyl N-(3-hydroxypropyl)carbamate34637-22-4 (2S,3R)-2-Amino-3-(benzyloxy)butanoic acid4378-10-3 N-Benzyloxycarbonyl-D-alaninol61425-27-2 Benzyl N-((2S)-1-hydroxypropan-2-yl)carbamate66674-16-6 (R)-4-Amino-3-(4-methoxyphenyl)butanoic acid740774-41-8

Elsewhere

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