Bis-tris methane

C₈H₁₉NO₅CAS 6976-37-0209.24 g/mol

Open in Covalent MOL file

Alcohol Tertiary amine

Properties

Molecular formula: C₈H₁₉NO₅
Molar mass: 209.24 g/mol
Exact mass: 209.1263 Da
logP: -3.01Crippen estimate
Polar surface area: 104.4 Å²
H-bond donors / acceptors: 5 / 6
Rotatable bonds: 8

Hazards

Danger

H315 Causes skin irritation37.6% of notifiers
H318 Causes serious eye damage54.2% of notifiers
H319 Causes serious eye irritation45% of notifiers
H335 May cause respiratory irritation36.5% of notifiers

Aggregated from 271 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, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

6976-37-0

SMILES

OCCN(CCO)C(CO)(CO)CO

InChIKey

OWMVSZAMULFTJU-UHFFFAOYSA-N

InChI

InChI=1S/C8H19NO5/c10-3-1-9(2-4-11)8(5-12,6-13)7-14/h10-14H,1-7H2

Weigh it out

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

Names and synonyms

7 names

1,3-Propanediol, 2-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)-
2-[Bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)-1,3-propanediol
2,2-Bis(hydroxymethyl)-2,2′,2′′-nitrilotriethanol
Bistris
NSC 119932
NSC 24868
NuPage bis-tris

Work with Bis-tris methane

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-Butyldiethanolamine2160-93-248 % similar Triethanolamine102-71-640 % similar 1-Aziridineethanol1072-52-238 % similar 1,4-Piperazinediethanol122-96-338 % similar N,N,N′,N′-Tetrakis(2-hydroxyethyl)ethylenediamine140-07-838 % similar Hexahydro-1,3,5-tris(2-hydroxyethyl)-s-triazine4719-04-436 % similar Methyl diethanolamine105-59-935 % similar 2-(Dimethylamino)ethanol108-01-035 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-Ethylglucamine14216-22-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia