CS-1012245
4-Chloro-5-fluoro-2-(pyrrolidin-1-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 3028826-82-3
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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
C₁₁H₁₀ClFN₂
Molecular Weight
224.66
Synonyms
None
SMILES
N#CC1=CC(F)=C(Cl)C=C1N2CCCC2
Tpsa
27.03
Logp
2.95098
H Acceptors
2
H Donors
0
Rotatable Bonds
1
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: C₁₁H₁₀ClFN₂
Molecular Weight: 224.66
Synonyms: None
SMILES: N#CC1=CC(F)=C(Cl)C=C1N2CCCC2
Tpsa: 27.03
Logp: 2.95098
H Acceptors: 2
H Donors: 0
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:
C₁₁H₁₀ClFN₂
Molecular Weight:
224.66
Synonyms:
None
SMILES:
N#CC1=CC(F)=C(Cl)C=C1N2CCCC2
Tpsa:
27.03
Logp:
2.95098
H Acceptors:
2
H Donors:
0
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: C₆H₉ClF₂N₂
Molecular Weight: 182.60
Synonyms: None
SMILES: N#CC1CNCCC1(F)F.Cl
Tpsa: 35.82
Logp: 1.17658
H Acceptors: 2
H Donors: 1
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:
C₆H₉ClF₂N₂
Molecular Weight:
182.60
Synonyms:
None
SMILES:
N#CC1CNCCC1(F)F.Cl
Tpsa:
35.82
Logp:
1.17658
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 97%
MDL No: None
Storage: 4°C, sealed storage, away from moisture and light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₂ClF₂N
Molecular Weight: 171.62
Synonyms: None
SMILES: C[C@@H]1C(F)(CCNC1)F.Cl
Tpsa: 12.03
Logp: 1.6729
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture and light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₂ClF₂N
Molecular Weight:
171.62
Synonyms:
None
SMILES:
C[C@@H]1C(F)(CCNC1)F.Cl
Tpsa:
12.03
Logp:
1.6729
H Acceptors:
1
H Donors:
1
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: C₁₀H₁₀BrClO₃
Molecular Weight: 293.54
Synonyms: None
SMILES: O=C(OC)CC1=CC(Cl)=C(OC)C(Br)=C1
Tpsa: 35.53
Logp: 2.8266
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₀BrClO₃
Molecular Weight:
293.54
Synonyms:
None
SMILES:
O=C(OC)CC1=CC(Cl)=C(OC)C(Br)=C1
Tpsa:
35.53
Logp:
2.8266
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3