CS-1001133
Afoxolaner Impurity 17
Manufacturer: ChemScene
CAS Number: 1352722-19-0
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₃H₁₆Cl₂F₃N₃O₃
Molecular Weight
510.29
Synonyms
None
SMILES
O=C(NC=NOC)C=1C=CC(C2=NOC(C=3C=C(Cl)C=C(Cl)C3)(C2)C(F)(F)F)=C4C=CC=CC14
Tpsa
72.28
Logp
6.0483
H Acceptors
5
H Donors
1
Rotatable Bonds
5
Related Products
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₁₆Cl₂F₃N₃O₃
Molecular Weight: 510.29
Synonyms: None
SMILES: O=C(NC=NOC)C=1C=CC(C2=NOC(C=3C=C(Cl)C=C(Cl)C3)(C2)C(F)(F)F)=C4C=CC=CC14
Tpsa: 72.28
Logp: 6.0483
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₁₆Cl₂F₃N₃O₃
Molecular Weight:
510.29
Synonyms:
None
SMILES:
O=C(NC=NOC)C=1C=CC(C2=NOC(C=3C=C(Cl)C=C(Cl)C3)(C2)C(F)(F)F)=C4C=CC=CC14
Tpsa:
72.28
Logp:
6.0483
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₀Cl₃NO₂
Molecular Weight: 330.59
Synonyms: None
SMILES: O=C(O)C(Cl)C=1C=CC=CC1NC=2C(Cl)=CC=CC2Cl
Tpsa: 49.33
Logp: 5.1015
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₀Cl₃NO₂
Molecular Weight:
330.59
Synonyms:
None
SMILES:
O=C(O)C(Cl)C=1C=CC=CC1NC=2C(Cl)=CC=CC2Cl
Tpsa:
49.33
Logp:
5.1015
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
4
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₁NO₂
Molecular Weight: 247.33
Synonyms: None
SMILES: O=C(N(CC)CC)C1(C=2C=CC=CC2)CC1CO
Tpsa: 40.54
Logp: 1.805
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 5
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₁NO₂
Molecular Weight:
247.33
Synonyms:
None
SMILES:
O=C(N(CC)CC)C1(C=2C=CC=CC2)CC1CO
Tpsa:
40.54
Logp:
1.805
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅₉H₇₉NO₁₄Si₂
Molecular Weight: 1082.43
Synonyms: None
SMILES: O(C(C)=O)[C@]12[C@@]3([C@@](C)([C@@H](O[Si](CC)(CC)CC)C[C@]1(OC2)[H])C(=O)[C@H](OC(C)=O)C=4C(C)(C)[C@](O)([C@H]3OC(=O)C5=CC=CC=C5)C[C@H](OC([C@@H]([C@@H](NC(=O)C6=CC=CC=C6)C7=CC=CC=C7)O[Si](CC)(CC)CC)=O)C4C)[H]
Tpsa: 199.29
Logp: 9.7947
H Acceptors: 14
H Donors: 2
Rotatable Bonds: 20
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₉H₇₉NO₁₄Si₂
Molecular Weight:
1082.43
Synonyms:
None
SMILES:
O(C(C)=O)[C@]12[C@@]3([C@@](C)([C@@H](O[Si](CC)(CC)CC)C[C@]1(OC2)[H])C(=O)[C@H](OC(C)=O)C=4C(C)(C)[C@](O)([C@H]3OC(=O)C5=CC=CC=C5)C[C@H](OC([C@@H]([C@@H](NC(=O)C6=CC=CC=C6)C7=CC=CC=C7)O[Si](CC)(CC)CC)=O)C4C)[H]
Tpsa:
199.29
Logp:
9.7947
H Acceptors:
14
H Donors:
2
Rotatable Bonds:
20