1-(Trimethylsilyl)-1H-benzotriazole

C₉H₁₃N₃SiCAS 43183-36-4191.31 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₃N₃Si
Molar mass: 191.31 g/mol
Exact mass: 191.0879 Da
logP: 2.11Crippen estimate
Polar surface area: 30.7 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Danger

H225 Highly Flammable liquid and vapor100% of notifiers
H315 Causes skin irritation97.6% of notifiers
H319 Causes serious eye irritation97.6% of notifiers
H335 May cause respiratory irritation97.6% of notifiers

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

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

43183-36-4

SMILES

C[Si](C)(C)N1C2=CC=CC=C2N=N1

InChIKey

VHOLOZYRMQVHBK-UHFFFAOYSA-N

InChI

InChI=1S/C9H13N3Si/c1-13(2,3)12-9-7-5-4-6-8(9)10-11-12/h4-7H,1-3H3

Weigh it out

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

Work with 1-(Trimethylsilyl)-1H-benzotriazole

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

1-Methylbenzotriazole13351-73-052 % similar 1-Hydroxy-1H-benzotriazole hydrate (1:?)123333-53-948 % similar 1-Hydroxybenzotriazole hydrate80029-43-248 % similar Hydroxybenzotriazole2592-95-248 % similar 1-Aminobenzotriazole1614-12-647 % similar 1H-Benzotriazole-1-methanol28539-02-843 % similar Bis(hydroxybenzotriazolyl) carbonate88544-01-841 % similar Benzotriazol-1-yl-acetic acid4144-64-337 % similar

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

Elsewhere

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