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[ CAS No. 3211-76-5 ] {[proInfo.proName]}

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There will be a HazMat fee per item when shipping a dangerous goods. The HazMat fee will be charged to your UPS/DHL/FedEx collect account or added to the invoice unless the package is shipped via Ground service. Ship by air in Excepted Quantity (each bottle), which is up to 1g/1mL for class 6.1 packing group I or II, and up to 25g/25ml for all other HazMat items.

Type HazMat fee for 500 gram (Estimated)
Excepted Quantity USD 0.00
Limited Quantity USD 15-60
Inaccessible (Haz class 6.1), Domestic USD 80+
Inaccessible (Haz class 6.1), International USD 150+
Accessible (Haz class 3, 4, 5 or 8), Domestic USD 100+
Accessible (Haz class 3, 4, 5 or 8), International USD 200+
Chemical Structure| 3211-76-5
Chemical Structure| 3211-76-5
Structure of 3211-76-5 * Storage: {[proInfo.prStorage]}

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Product Details of [ 3211-76-5 ]

CAS No. :3211-76-5 MDL No. :MFCD00037210
Formula : C5H11NO2Se Boiling Point : -
Linear Structure Formula :OHCOCHNH2(CH2)2SeCH3 InChI Key :RJFAYQIBOAGBLC-BYPYZUCNSA-N
M.W : 196.11 Pubchem ID :105024
Synonyms :
Chemical Name :L-SelenoMethionine

Calculated chemistry of [ 3211-76-5 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 9
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.8
Num. rotatable bonds : 4
Num. H-bond acceptors : 3.0
Num. H-bond donors : 2.0
Molar Refractivity : 36.38
TPSA : 63.32 ?2

Pharmacokinetics

GI absorption : High
BBB permeant : No
P-gp substrate : No
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -8.99 cm/s

Lipophilicity

Log Po/w (iLOGP) : 0.0
Log Po/w (XLOGP3) : -2.11
Log Po/w (WLOGP) : -0.04
Log Po/w (MLOGP) : -2.2
Log Po/w (SILICOS-IT) : -1.24
Consensus Log Po/w : -1.12

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 2.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : 0.54
Solubility : 676.0 mg/ml ; 3.45 mol/l
Class : Highly soluble
Log S (Ali) : 1.31
Solubility : 3990.0 mg/ml ; 20.4 mol/l
Class : Highly soluble
Log S (SILICOS-IT) : -0.42
Solubility : 75.1 mg/ml ; 0.383 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 3.01

Safety of [ 3211-76-5 ]

Signal Word:Danger Class:6.1
Precautionary Statements:P501-P273-P260-P270-P271-P264-P280-P391-P314-P337+P313-P305+P351+P338-P302+P352-P332+P313-P362-P301+P310+P330-P304+P340+P311-P403+P233-P405 UN#:3283
Hazard Statements:H301+H331-H315-H319-H373-H410 Packing Group:
GHS Pictogram:
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