CS-0915591
1H-Pyrazole-3-carboxylic acid, 5-fluoro-1-(phenylmethyl)-
Manufacturer: ChemScene
CAS Number: 3002976-92-0
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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
C₁₁H₉FN₂O₂
Molecular Weight
220.20
Synonyms
None
SMILES
O=C(C1=NN(CC2=CC=CC=C2)C(F)=C1)O
Tpsa
55.12
Logp
1.7687
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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: C₁₁H₉FN₂O₂
Molecular Weight: 220.20
Synonyms: None
SMILES: O=C(C1=NN(CC2=CC=CC=C2)C(F)=C1)O
Tpsa: 55.12
Logp: 1.7687
H Acceptors: 3
H Donors: 1
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:
C₁₁H₉FN₂O₂
Molecular Weight:
220.20
Synonyms:
None
SMILES:
O=C(C1=NN(CC2=CC=CC=C2)C(F)=C1)O
Tpsa:
55.12
Logp:
1.7687
H Acceptors:
3
H Donors:
1
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: C₁₀H₄BrClFNO₂
Molecular Weight: 304.50
Synonyms: None
SMILES: O=CC1=C(Cl)C2=C(NC1=O)C(F)=C(Br)C=C2
Tpsa: 49.93
Logp: 2.8956
H Acceptors: 2
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:
C₁₀H₄BrClFNO₂
Molecular Weight:
304.50
Synonyms:
None
SMILES:
O=CC1=C(Cl)C2=C(NC1=O)C(F)=C(Br)C=C2
Tpsa:
49.93
Logp:
2.8956
H Acceptors:
2
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: C₁₄H₁₇BFN₃O₂
Molecular Weight: 289.11
Synonyms: None
SMILES: NC1=NC=C2C(F)=C(B3OC(C)(C)C(C)(C)O3)C=CC2=N1
Tpsa: 70.26
Logp: 1.6503
H Acceptors: 5
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:
C₁₄H₁₇BFN₃O₂
Molecular Weight:
289.11
Synonyms:
None
SMILES:
NC1=NC=C2C(F)=C(B3OC(C)(C)C(C)(C)O3)C=CC2=N1
Tpsa:
70.26
Logp:
1.6503
H Acceptors:
5
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: C₁₀H₁₁BrN₄O
Molecular Weight: 283.12
Synonyms: None
SMILES: COCCNC1=NC=C2C=C(C=NC2=N1)Br
Tpsa: 59.93
Logp: 1.8456
H Acceptors: 5
H Donors: 1
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:
C₁₀H₁₁BrN₄O
Molecular Weight:
283.12
Synonyms:
None
SMILES:
COCCNC1=NC=C2C=C(C=NC2=N1)Br
Tpsa:
59.93
Logp:
1.8456
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4