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[ CAS No. 95-10-3 ] {[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| 95-10-3
Chemical Structure| 95-10-3
Structure of 95-10-3 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 95-10-3 ]

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Product Details of [ 95-10-3 ]

CAS No. :95-10-3 MDL No. :MFCD07369043
Formula : C8H13N Boiling Point : -
Linear Structure Formula :- InChI Key :XLBALIGLOMYEKN-UHFFFAOYSA-N
M.W : 123.20 Pubchem ID :247182
Synonyms :
Chemical Name :5-Norbornene-2-methylamine (mixture of isomers)

Calculated chemistry of [ 95-10-3 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 9
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.75
Num. rotatable bonds : 1
Num. H-bond acceptors : 1.0
Num. H-bond donors : 1.0
Molar Refractivity : 38.58
TPSA : 26.02 ?2

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -6.38 cm/s

Lipophilicity

Log Po/w (iLOGP) : 1.89
Log Po/w (XLOGP3) : 0.95
Log Po/w (WLOGP) : 1.16
Log Po/w (MLOGP) : 1.68
Log Po/w (SILICOS-IT) : 1.06
Consensus Log Po/w : 1.35

Druglikeness

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

Water Solubility

Log S (ESOL) : -1.14
Solubility : 9.0 mg/ml ; 0.0731 mol/l
Class : Very soluble
Log S (Ali) : -1.08
Solubility : 10.2 mg/ml ; 0.0825 mol/l
Class : Very soluble
Log S (SILICOS-IT) : -0.66
Solubility : 27.0 mg/ml ; 0.219 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 4.36

Safety of [ 95-10-3 ]

Signal Word:Danger Class:8
Precautionary Statements:P280-P305+P351+P338-P310 UN#:2735
Hazard Statements:H227-H314 Packing Group:
GHS Pictogram:
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