CS-0617524
(2S,4S)-4-Fluoro-1-(2-oxoacetyl)pyrrolidine-2-carbonitrile
Manufacturer: ChemScene
CAS Number: 1087103-79-4
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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
C₇H₇FN₂O₂
Molecular Weight
170.14
Synonyms
None
SMILES
N#C[C@H]1N(C(C=O)=O)C[C@@H](F)C1
Tpsa
61.17
Logp
-0.35212
H Acceptors
3
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: C₇H₇FN₂O₂
Molecular Weight: 170.14
Synonyms: None
SMILES: N#C[C@H]1N(C(C=O)=O)C[C@@H](F)C1
Tpsa: 61.17
Logp: -0.35212
H Acceptors: 3
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:
C₇H₇FN₂O₂
Molecular Weight:
170.14
Synonyms:
None
SMILES:
N#C[C@H]1N(C(C=O)=O)C[C@@H](F)C1
Tpsa:
61.17
Logp:
-0.35212
H Acceptors:
3
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: C₁₃H₁₆N₂O₃
Molecular Weight: 248.28
Synonyms: None
SMILES: O=C1NC2=CC=C(OC)C=C2C3(CCNCC3)O1
Tpsa: 59.59
Logp: 1.836
H Acceptors: 4
H Donors: 2
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:
C₁₃H₁₆N₂O₃
Molecular Weight:
248.28
Synonyms:
None
SMILES:
O=C1NC2=CC=C(OC)C=C2C3(CCNCC3)O1
Tpsa:
59.59
Logp:
1.836
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆BrFO
Molecular Weight: 217.04
Synonyms: None
SMILES: O=CC1=C(F)C=CC(Br)=C1C
Tpsa: 17.07
Logp: 2.70912
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆BrFO
Molecular Weight:
217.04
Synonyms:
None
SMILES:
O=CC1=C(F)C=CC(Br)=C1C
Tpsa:
17.07
Logp:
2.70912
H Acceptors:
1
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: C₁₀H₉ClN₂O
Molecular Weight: 208.64
Synonyms: None
SMILES: NC1=C2N=CC=C(Cl)C2=CC(OC)=C1
Tpsa: 48.14
Logp: 2.479
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:
C₁₀H₉ClN₂O
Molecular Weight:
208.64
Synonyms:
None
SMILES:
NC1=C2N=CC=C(Cl)C2=CC(OC)=C1
Tpsa:
48.14
Logp:
2.479
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1