CS-0448544
3-(3,3-Difluoropyrrolidin-1-yl)picolinaldehyde
Manufacturer: ChemScene
CAS Number: 1779131-98-4
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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
C₁₀H₁₀F₂N₂O
Molecular Weight
212.20
Synonyms
None
SMILES
C1=CC(=C(C=O)N=C1)N2CCC(C2)(F)F
Tpsa
33.2
Logp
1.7395
H Acceptors
3
H Donors
0
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
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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: C₁₀H₁₀F₂N₂O
Molecular Weight: 212.20
Synonyms: None
SMILES: C1=CC(=C(C=O)N=C1)N2CCC(C2)(F)F
Tpsa: 33.2
Logp: 1.7395
H Acceptors: 3
H Donors: 0
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:
C₁₀H₁₀F₂N₂O
Molecular Weight:
212.20
Synonyms:
None
SMILES:
C1=CC(=C(C=O)N=C1)N2CCC(C2)(F)F
Tpsa:
33.2
Logp:
1.7395
H Acceptors:
3
H Donors:
0
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: C₁₅H₂₀O₃S₂
Molecular Weight: 312.45
Synonyms: ethyl 3-butylthio-4-oxo-5,6,7-trihydrobenzo[1,2-c]thiophenecarboxylate
SMILES: CCCCSC1=C2C(=C(C(=O)OCC)S1)CCCC2=O
Tpsa: 43.37
Logp: 4.336
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₀O₃S₂
Molecular Weight:
312.45
Synonyms:
ethyl 3-butylthio-4-oxo-5,6,7-trihydrobenzo[1,2-c]thiophenecarboxylate
SMILES:
CCCCSC1=C2C(=C(C(=O)OCC)S1)CCCC2=O
Tpsa:
43.37
Logp:
4.336
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₈O₃S₂
Molecular Weight: 298.42
Synonyms: None
SMILES: CCSC1=C2C(=C(C(=O)OC)S1)CC(C)(C)CC2=O
Tpsa: 43.37
Logp: 3.8018
H Acceptors: 5
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:
C₁₄H₁₈O₃S₂
Molecular Weight:
298.42
Synonyms:
None
SMILES:
CCSC1=C2C(=C(C(=O)OC)S1)CC(C)(C)CC2=O
Tpsa:
43.37
Logp:
3.8018
H Acceptors:
5
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: C₆H₁₁NO₂
Molecular Weight: 129.16
Synonyms: 2,5-Dihydroxy-capronsaeure-nitril
SMILES: C(CCO)CC(C#N)O
Tpsa: 64.25
Logp: 0.03348
H Acceptors: 3
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:
C₆H₁₁NO₂
Molecular Weight:
129.16
Synonyms:
2,5-Dihydroxy-capronsaeure-nitril
SMILES:
C(CCO)CC(C#N)O
Tpsa:
64.25
Logp:
0.03348
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4