chempirical

4-(((tert-Butoxy)carbonyl)amino)butanoic acid

C9H17NO4CAS 57294-38-9203.24 g/mol

Open in Covalent MOL file
OONHOOH
CarbamateCarboxylic acid

Properties

Molecular formula
C9H17NO4
Molar mass
203.24 g/mol
Exact mass
203.1158 Da
logP
1.38Crippen estimate
Polar surface area
75.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
57294-38-9
SMILES
CC(C)(C)OC(=O)NCCCC(=O)O
InChIKey
HIDJWBGOQFTDLU-UHFFFAOYSA-N
InChI
InChI=1S/C9H17NO4/c1-9(2,3)14-8(13)10-6-4-5-7(11)12/h4-6H2,1-3H3,(H,10,13)(H,11,12)

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Names and synonyms

1 names
  • Boc-gamma-abu-oh

Work with 4-(((tert-Butoxy)carbonyl)amino)butanoic acid

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

Boc-5-aminopentanoic acid27219-07-491 % similar Boc-11-aminoundecanoic acid10436-25-688 % similar 7-(((tert-Butoxy)carbonyl)amino)heptanoic acid60142-89-488 % similar T-Boc-N-amido-peg1-acid1260092-44-171 % similar 3-(Boc-amino)-1-propanol58885-58-864 % similar tert-Butyl N-(4-hydroxybutyl)carbamate75178-87-962 % similar 3,8,11-Trioxa-5-azatridecan-13-oic acid, 2,2-dimethyl-4-oxo-108466-89-361 % similar tert-Butyl N-(6-hydroxyhexyl)carbamate75937-12-161 % similar

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

Same formula

(R)-3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid132696-45-8 tert-Butoxycarbonylamino-acetic acid ethyl ester14719-37-0 Boc-N-ethyl glycine149794-10-5 (3S)-3-(((tert-Butoxy)carbonyl)amino)butanoic acid158851-30-0 (3R)-3-[[(1,1-Dimethylethoxy)carbonyl]amino]butanoic acid159991-23-8 Boc-N-methyl-L-alanine16948-16-6 (3R,4S)-tert-Butyl 3,4-dihydroxypyrrolidine-1-carboxylate186393-22-6 (S)-3-(Boc-amino)-2-methylpropionic acid190897-47-3

Elsewhere

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