Dastib 845

C₉₉H₁₉₈O₉CAS 86403-32-91532.66 g/mol

Open in Covalent MOL file

Alcohol

Properties

Molecular formula: C₉₉H₁₉₈O₉
Molar mass: 1532.66 g/mol
Exact mass: 1531.5036 Da
logP: 24.17Crippen estimate
Polar surface area: 182.1 Å²
H-bond donors / acceptors: 9 / 9
Rotatable bonds: 9

Hazards

Danger

H317 May cause an allergic skin reactionSensitization, Skin
H318 Causes serious eye damageSerious eye damage/eye irritation
H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
H410 Very toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 607-383-00-9), via PubChem.

Precautionary statements

P261, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P321, P333+P317, P362+P364, P391, P501

Identifiers

CAS number

86403-32-9

SMILES

CC1CCC(C(C1C)O)C(C)C.CC1CCC(C(C1C(C)C)O)C.CC1CC(C(C(C1)C(C)C)O)C.CC1CC(C(C(C1)O)C(C)C)C.CC1CC(CC(C1O)C)C(C)C.CC1CC(CC(C1C(C)C)C)O.CC1CC(C(CC1C)O)C(C)C.CC1CC(C(CC1O)C)C(C)C.CC1C(C(CCC1C(C)C)O)C

InChIKey

KHAOVIRKEPJQQT-UHFFFAOYSA-N

InChI

InChI=1S/9C11H22O/c1-7(2)10-5-9(4)11(12)6-8(10)3;1-7(2)11-8(3)5-10(12)6-9(11)4;1-7(2)10-5-8(3)11(12)9(4)6-10;1-7(2)10-5-8(3)9(4)6-11(10)12;1-7(2)11-9(4)5-8(3)6-10(11)12;1-7(2)10-6-8(3)5-9(4)11(10)12;1-7(2)10-5-6-11(12)9(4)8(10)3;1-7(2)10-6-5-8(3)9(4)11(10)12;1-7(2)10-8(3)5-6-9(4)11(10)12/h9*7-12H,5-6H2,1-4H3

Weigh it out

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

Names and synonyms

5 names

Fatty acids, C15-18, tetramethylpiperidinyl esters
C15-18 Fatty acids, tetramethylpiperidinol esters
Fatty acid esters, C15-18, tetramethylpiperidinyl esters
Licovin 845
Hostavin N 845

Work with Dastib 845

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

Elsewhere

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