CS-0568319
4-(((1s,4s)-4-aminocyclohexyl)oxy)-2-chlorobenzonitrile
Manufacturer: ChemScene
CAS Number: 2222118-98-9
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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
C₁₃H₁₅ClN₂O
Molecular Weight
250.72
Synonyms
None
SMILES
ClC(C=C(C=C1)O[C@@H](CC2)CC[C@@H]2N)=C1C#N
Tpsa
59.04
Logp
2.86038
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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SAFETY INFORMATION
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: C₁₃H₁₅ClN₂O
Molecular Weight: 250.72
Synonyms: None
SMILES: ClC(C=C(C=C1)O[C@@H](CC2)CC[C@@H]2N)=C1C#N
Tpsa: 59.04
Logp: 2.86038
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅ClN₂O
Molecular Weight:
250.72
Synonyms:
None
SMILES:
ClC(C=C(C=C1)O[C@@H](CC2)CC[C@@H]2N)=C1C#N
Tpsa:
59.04
Logp:
2.86038
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₅IN₂O₂
Molecular Weight: 252.01
Synonyms: 1H-Pyrazole-4-carboxylic acid, 3-iodo-, methyl ester
SMILES: O=C(C1=CNN=C1I)OC
Tpsa: 54.98
Logp: 0.8009
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₅IN₂O₂
Molecular Weight:
252.01
Synonyms:
1H-Pyrazole-4-carboxylic acid, 3-iodo-, methyl ester
SMILES:
O=C(C1=CNN=C1I)OC
Tpsa:
54.98
Logp:
0.8009
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₃BrN₂O
Molecular Weight: 186.99
Synonyms: None
SMILES: N#CC1=C(Br)OC(C)=N1
Tpsa: 49.82
Logp: 1.6172
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₃BrN₂O
Molecular Weight:
186.99
Synonyms:
None
SMILES:
N#CC1=C(Br)OC(C)=N1
Tpsa:
49.82
Logp:
1.6172
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₅ClFI
Molecular Weight: 270.47
Synonyms: 2-Iodo-4-chloro-5-fluorotoluene
SMILES: CC1=C(I)C=C(Cl)C(F)=C1
Tpsa: 0
Logp: 3.39212
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₅ClFI
Molecular Weight:
270.47
Synonyms:
2-Iodo-4-chloro-5-fluorotoluene
SMILES:
CC1=C(I)C=C(Cl)C(F)=C1
Tpsa:
0
Logp:
3.39212
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
0