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+ |
Purity | Size | Price | VIP Price | USA Stock *0-1 Day | Global Stock *5-7 Days | Quantity | |||||
{[ item.p_purity ]} | {[ item.pr_size ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} | Inquiry {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} {[ getRatePrice(item.pr_usd,1,item.mem_rate) ]} | {[ item.pr_usastock ]} | Inquiry - | {[ item.pr_chinastock ]} | Inquiry - |
* Storage: {[proInfo.prStorage]}
CAS No. : | 1735-53-1 | MDL No. : | MFCD03095347 |
Formula : | C8H3BrF3N | Boiling Point : | - |
Linear Structure Formula : | - | InChI Key : | KSXUIQQDHHFSRN-UHFFFAOYSA-N |
M.W : | 250.02 | Pubchem ID : | 10800647 |
Synonyms : |
|
Num. heavy atoms : | 13 |
Num. arom. heavy atoms : | 6 |
Fraction Csp3 : | 0.12 |
Num. rotatable bonds : | 1 |
Num. H-bond acceptors : | 4.0 |
Num. H-bond donors : | 0.0 |
Molar Refractivity : | 43.86 |
TPSA : | 23.79 Ų |
GI absorption : | High |
BBB permeant : | Yes |
P-gp substrate : | No |
CYP1A2 inhibitor : | Yes |
CYP2C19 inhibitor : | No |
CYP2C9 inhibitor : | No |
CYP2D6 inhibitor : | No |
CYP3A4 inhibitor : | No |
Log Kp (skin permeation) : | -5.54 cm/s |
Log Po/w (iLOGP) : | 2.05 |
Log Po/w (XLOGP3) : | 3.22 |
Log Po/w (WLOGP) : | 4.49 |
Log Po/w (MLOGP) : | 3.23 |
Log Po/w (SILICOS-IT) : | 3.5 |
Consensus Log Po/w : | 3.3 |
Lipinski : | 0.0 |
Ghose : | None |
Veber : | 0.0 |
Egan : | 0.0 |
Muegge : | 1.0 |
Bioavailability Score : | 0.55 |
Log S (ESOL) : | -3.69 |
Solubility : | 0.0506 mg/ml ; 0.000202 mol/l |
Class : | Soluble |
Log S (Ali) : | -3.39 |
Solubility : | 0.101 mg/ml ; 0.000405 mol/l |
Class : | Soluble |
Log S (SILICOS-IT) : | -4.23 |
Solubility : | 0.0148 mg/ml ; 0.0000593 mol/l |
Class : | Moderately soluble |
PAINS : | 0.0 alert |
Brenk : | 0.0 alert |
Leadlikeness : | 0.0 |
Synthetic accessibility : | 1.83 |
Signal Word: | Danger | Class: | 6.1 |
Precautionary Statements: | P261-P270-P271-P264-P280-P337+P313-P305+P351+P338-P361+P364-P332+P313-P301+P310+P330-P302+P352+P312-P304+P340+P311-P403+P233-P405-P501 | UN#: | 3439 |
Hazard Statements: | H301+H311+H331-H315-H319 | Packing Group: | Ⅲ |
GHS Pictogram: |
* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.
[ 1483-55-2 ]
2-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.96
[ 35764-15-9 ]
2-Bromo-4-(trifluoromethyl)benzonitrile
Similarity: 0.94
[ 914637-07-3 ]
2-Bromo-3-(trifluoromethyl)benzonitrile
Similarity: 0.93
[ 691877-03-9 ]
3-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 191165-13-6 ]
4-Bromo-2-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 1483-55-2 ]
2-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.96
[ 35764-15-9 ]
2-Bromo-4-(trifluoromethyl)benzonitrile
Similarity: 0.94
[ 914637-07-3 ]
2-Bromo-3-(trifluoromethyl)benzonitrile
Similarity: 0.93
[ 691877-03-9 ]
3-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 191165-13-6 ]
4-Bromo-2-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 1483-55-2 ]
2-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.96
[ 35764-15-9 ]
2-Bromo-4-(trifluoromethyl)benzonitrile
Similarity: 0.94
[ 914637-07-3 ]
2-Bromo-3-(trifluoromethyl)benzonitrile
Similarity: 0.93
[ 691877-03-9 ]
3-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 191165-13-6 ]
4-Bromo-2-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 1483-55-2 ]
2-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.96
[ 35764-15-9 ]
2-Bromo-4-(trifluoromethyl)benzonitrile
Similarity: 0.94
[ 914637-07-3 ]
2-Bromo-3-(trifluoromethyl)benzonitrile
Similarity: 0.93
[ 691877-03-9 ]
3-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 191165-13-6 ]
4-Bromo-2-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 1483-55-2 ]
2-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.96
[ 35764-15-9 ]
2-Bromo-4-(trifluoromethyl)benzonitrile
Similarity: 0.94
[ 914637-07-3 ]
2-Bromo-3-(trifluoromethyl)benzonitrile
Similarity: 0.93
[ 691877-03-9 ]
3-Bromo-5-(trifluoromethyl)benzonitrile
Similarity: 0.90
[ 191165-13-6 ]
4-Bromo-2-(trifluoromethyl)benzonitrile
Similarity: 0.90