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[ CAS No. 13755-38-9 ] {[proInfo.proName]}

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Cat. No.: {[proInfo.prAm]}
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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| 13755-38-9
Chemical Structure| 13755-38-9
Structure of 13755-38-9 * Storage: {[proInfo.prStorage]}
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Product Details of [ 13755-38-9 ]

CAS No. :13755-38-9 MDL No. :MFCD00149192
Formula : C5H4FeN6Na2O3 Boiling Point : -
Linear Structure Formula :- InChI Key :XRKMNJXYOFSTBE-UHFFFAOYSA-N
M.W : 297.95 Pubchem ID :11953895
Synonyms :
Sodium nitroprusside dihydrate;Sodium Nitroferricyanide(III) Dihydrate

Calculated chemistry of [ 13755-38-9 ]

Physicochemical Properties

Num. heavy atoms : 17
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.0
Num. rotatable bonds : 0
Num. H-bond acceptors : 9.0
Num. H-bond donors : 2.0
Molar Refractivity : 36.57
TPSA : 161.2 Ų

Pharmacokinetics

GI absorption : Low
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) : -8.95 cm/s

Lipophilicity

Log Po/w (iLOGP) : 0.0
Log Po/w (XLOGP3) : -1.17
Log Po/w (WLOGP) : -0.15
Log Po/w (MLOGP) : -5.31
Log Po/w (SILICOS-IT) : -4.21
Consensus Log Po/w : -2.17

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 1.0
Egan : 1.0
Muegge : 1.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -0.95
Solubility : 33.4 mg/ml ; 0.112 mol/l
Class : Very soluble
Log S (Ali) : -1.72
Solubility : 5.65 mg/ml ; 0.019 mol/l
Class : Very soluble
Log S (SILICOS-IT) : -0.63
Solubility : 70.0 mg/ml ; 0.235 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 3.0 alert
Leadlikeness : 0.0
Synthetic accessibility : 5.03

Safety of [ 13755-38-9 ]

Signal Word:Danger Class:6.1
Precautionary Statements:P264-P270-P301+P310+P330-P405-P501 UN#:3288
Hazard Statements:H301 Packing Group:
GHS Pictogram:
Same Skeleton Products
Historical Records

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[ 13755-38-9 ]

Chemical Structure| 14402-89-2

A1155149[ 14402-89-2 ]

Sodium Nitroferricyanide(III)

Reason: Hydrate