CS-0644697
rel-Methyl 4-bromo-2-((1R,2R)-1-cyano-2-fluorocyclopropyl)benzoate
Manufacturer: ChemScene
CAS Number: 2771023-27-7
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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
C₁₂H₉BrFNO₂
Molecular Weight
298.11
Synonyms
None
SMILES
O=C(OC)C1=CC=C(Br)C=C1[C@]2(C#N)[C@H](F)C2
Tpsa
50.09
Logp
2.73888
H Acceptors
3
H Donors
0
Rotatable Bonds
2
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: C₁₂H₉BrFNO₂
Molecular Weight: 298.11
Synonyms: None
SMILES: O=C(OC)C1=CC=C(Br)C=C1[C@]2(C#N)[C@H](F)C2
Tpsa: 50.09
Logp: 2.73888
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:
C₁₂H₉BrFNO₂
Molecular Weight:
298.11
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C(Br)C=C1[C@]2(C#N)[C@H](F)C2
Tpsa:
50.09
Logp:
2.73888
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: C₈H₁₄ClN₃O
Molecular Weight: 203.67
Synonyms: None
SMILES: N[C@H](CCC1)[C@H]1OC2=CNN=C2.Cl
Tpsa: 63.93
Logp: 1.0901
H Acceptors: 3
H Donors: 2
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:
C₈H₁₄ClN₃O
Molecular Weight:
203.67
Synonyms:
None
SMILES:
N[C@H](CCC1)[C@H]1OC2=CNN=C2.Cl
Tpsa:
63.93
Logp:
1.0901
H Acceptors:
3
H Donors:
2
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: C₁₂H₁₃ClN₂O₃
Molecular Weight: 268.70
Synonyms: None
SMILES: COCCOC1=CC2=NC=CC(Cl)=C2N=C1OC
Tpsa: 53.47
Logp: 2.317
H Acceptors: 5
H Donors: 0
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:
C₁₂H₁₃ClN₂O₃
Molecular Weight:
268.70
Synonyms:
None
SMILES:
COCCOC1=CC2=NC=CC(Cl)=C2N=C1OC
Tpsa:
53.47
Logp:
2.317
H Acceptors:
5
H Donors:
0
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: C₈H₁₀BrNO₂
Molecular Weight: 232.07
Synonyms: None
SMILES: CC1=C(Br)C=NC=C1OCOC
Tpsa: 31.35
Logp: 2.13522
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:
C₈H₁₀BrNO₂
Molecular Weight:
232.07
Synonyms:
None
SMILES:
CC1=C(Br)C=NC=C1OCOC
Tpsa:
31.35
Logp:
2.13522
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3