CS-0805456
4-Borono-1-ethyl-3-methyl-1H-pyrazole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1799978-88-3
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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
C₇H₁₁BN₂O₄
Molecular Weight
197.98
Synonyms
None
SMILES
O=C(C1=C(B(O)O)C(C)=NN1CC)O
Tpsa
95.58
Logp
-1.41058
H Acceptors
5
H Donors
3
Rotatable Bonds
3
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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: C₇H₁₁BN₂O₄
Molecular Weight: 197.98
Synonyms: None
SMILES: O=C(C1=C(B(O)O)C(C)=NN1CC)O
Tpsa: 95.58
Logp: -1.41058
H Acceptors: 5
H Donors: 3
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:
C₇H₁₁BN₂O₄
Molecular Weight:
197.98
Synonyms:
None
SMILES:
O=C(C1=C(B(O)O)C(C)=NN1CC)O
Tpsa:
95.58
Logp:
-1.41058
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD24040274
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₅BF₃NO₃
Molecular Weight: 277.05
Synonyms: None
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=NOC(=C2C)C(F)(F)F
Tpsa: 44.49
Logp: 2.30102
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD24040274
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅BF₃NO₃
Molecular Weight:
277.05
Synonyms:
None
SMILES:
B1(OC(C(O1)(C)C)(C)C)C2=NOC(=C2C)C(F)(F)F
Tpsa:
44.49
Logp:
2.30102
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD11043446
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₁BClNO₂
Molecular Weight: 199.44
Synonyms: None
SMILES: B(C1=CC(=NC(=C1)Cl)C(C)C)(O)O
Tpsa: 53.35
Logp: 0.5382
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD11043446
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₁BClNO₂
Molecular Weight:
199.44
Synonyms:
None
SMILES:
B(C1=CC(=NC(=C1)Cl)C(C)C)(O)O
Tpsa:
53.35
Logp:
0.5382
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: C₅H₈FNO₂
Molecular Weight: 133.12
Synonyms: None
SMILES: C1C[C@@](NC1)(C(=O)O)F
Tpsa: 49.33
Logp: 0.1202
H Acceptors: 2
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:
C₅H₈FNO₂
Molecular Weight:
133.12
Synonyms:
None
SMILES:
C1C[C@@](NC1)(C(=O)O)F
Tpsa:
49.33
Logp:
0.1202
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1