tert-Butyl N-(1-(hydroxymethyl)cyclopropyl)carbamate

C9H17NO3CAS 107017-73-2187.24 g/mol

Open in Covalent MOL file
OOHNOH
AlcoholCarbamate

Properties

Molecular formula
C9H17NO3
Molar mass
187.24 g/mol
Exact mass
187.1208 Da
logP
1.04Crippen estimate
Polar surface area
58.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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
107017-73-2
SMILES
CC(C)(C)OC(=O)NC1(CC1)CO
InChIKey
HFMAZNJKNNRONT-UHFFFAOYSA-N
InChI
InChI=1S/C9H17NO3/c1-8(2,3)13-7(12)10-9(6-11)4-5-9/h11H,4-6H2,1-3H3,(H,10,12)

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Names and synonyms

1 names
  • N-Boc-1-amino-cyclopropanemethanol

Work with tert-Butyl N-(1-(hydroxymethyl)cyclopropyl)carbamate

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-[1-(2-aminoethyl)cyclopropyl]carbamate753023-60-863 % similar N-Boc-alpha-methyl-D-serine84311-18-258 % similar tert-Butyl (3-aminobicyclo[1.1.1]pent-1-yl)carbamate1638767-25-556 % similar (R)-Methyl 2-((tert-butoxycarbonyl)amino)-3-hydroxy-2-methylpropanoate188476-28-055 % similar N-Boc-1-aminocyclobutanecarboxylic acid120728-10-151 % similar 1-tert-Butoxycarbonylamino-cyclohexanecarboxylic acid115951-16-150 % similar tert-Butyl N-(2-hydroxyethyl)carbamate26690-80-250 % similar Benzyl (1-(hydroxymethyl)cyclopropyl)carbamate103500-22-748 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(S)-3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester101469-92-5 3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester103057-44-9 tert-Butyl (3R)-3-hydroxypyrrolidine-1-carboxylate109431-87-0 3-Hydroxy-3-methyl-azetidine-1-carboxylic acid tert-butyl ester1104083-23-9 1-Boc-azetidine-3-ylmethanol142253-56-3 tert-Butyl (2S)-2-(hydroxymethyl)azetidine-1-carboxylate161511-85-9 tert-Butyl 2-(hydroxymethyl)azetidine-1-carboxylate174346-82-8 3-(Carbamoylmethyl)-5-methylhexanoic acid181289-15-6

Elsewhere

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