Acetic acid N-hydroxysuccinimide ester

C₆H₇NO₄CAS 14464-29-0157.12 g/mol

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Properties

Molecular formula: C₆H₇NO₄
Molar mass: 157.12 g/mol
Exact mass: 157.0375 Da
Melting point: 131–132 °C
logP: -0.39Crippen estimate
Polar surface area: 63.7 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed90.7% of notifiers
H317 May cause an allergic skin reaction90.7% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P333+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

14464-29-0

SMILES

CC(=O)ON1C(=O)CCC1=O

InChIKey

SIFCHNIAAPMMKG-UHFFFAOYSA-N

InChI

InChI=1S/C6H7NO4/c1-4(8)11-7-5(9)2-3-6(7)10/h2-3H2,1H3

Weigh it out

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

Names and synonyms

9 names

O-Acetyl-N,N-succinyl hydroxylamine
N-Hydroxysuccinimidyl acetate
Ac-OSu
(2,5-Dioxopyrrolidin-1-yl) acetate
2,5-Pyrrolidinedione, 1-(acetyloxy)-
Succinimide, N-acetoxy-
1-(Acetyloxy)-2,5-pyrrolidinedione
N-Acetoxysuccinimide
N-Hydroxysuccinimide acetate

Work with Acetic acid N-hydroxysuccinimide 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

Di(succinimido) carbonate74124-79-154 % similar N-Succinimidyl-N-methylcarbamate18342-66-050 % similar Disuccinimidyl glutarate79642-50-550 % similar Disuccinimidyl suberate68528-80-346 % similar N-Hydroxysuccinimide S-acetylthioacetate76931-93-645 % similar tert-Butyl succinimidyl carbonate13139-12-345 % similar Iodoacetic acid N-hydroxysuccinimide ester39028-27-845 % similar Bromoacetic acid N-hydroxysuccinimide ester42014-51-745 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook