CS-0804483
(1-(Cyanomethyl)-1H-pyrazol-4-yl)boronic acid
Manufacturer: ChemScene
CAS Number: 1691206-28-6
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Purity
98%
MDL No
MFCD29078843
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₅H₆BN₃O₂
Molecular Weight
150.93
Synonyms
None
SMILES
B(C1=CN(N=C1)CC#N)(O)O
Tpsa
82.07
Logp
-1.91352
H Acceptors
5
H Donors
2
Rotatable Bonds
2
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: MFCD29078843
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₆BN₃O₂
Molecular Weight: 150.93
Synonyms: None
SMILES: B(C1=CN(N=C1)CC#N)(O)O
Tpsa: 82.07
Logp: -1.91352
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD29078843
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₆BN₃O₂
Molecular Weight:
150.93
Synonyms:
None
SMILES:
B(C1=CN(N=C1)CC#N)(O)O
Tpsa:
82.07
Logp:
-1.91352
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD25376618
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃BrF₂N₂O₃
Molecular Weight: 281.01
Synonyms: None
SMILES: C1=C(C(=C(N=C1[N+](=O)[O-])C(F)F)C=O)Br
Tpsa: 73.1
Logp: 2.5024
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD25376618
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃BrF₂N₂O₃
Molecular Weight:
281.01
Synonyms:
None
SMILES:
C1=C(C(=C(N=C1[N+](=O)[O-])C(F)F)C=O)Br
Tpsa:
73.1
Logp:
2.5024
H Acceptors:
4
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: C₇H₉BN₄O₃
Molecular Weight: 207.98
Synonyms: None
SMILES: B(C1=CC(=NN1C)C2=NOC(=N2)C)(O)O
Tpsa: 97.2
Logp: -1.54168
H Acceptors: 7
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:
C₇H₉BN₄O₃
Molecular Weight:
207.98
Synonyms:
None
SMILES:
B(C1=CC(=NN1C)C2=NOC(=N2)C)(O)O
Tpsa:
97.2
Logp:
-1.54168
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD23381996
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₅F₃O₃
Molecular Weight: 230.14
Synonyms: None
SMILES: C1=CC(=C2C=C(OC2=C1)C(=O)O)C(F)(F)F
Tpsa: 50.44
Logp: 3.1498
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD23381996
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₅F₃O₃
Molecular Weight:
230.14
Synonyms:
None
SMILES:
C1=CC(=C2C=C(OC2=C1)C(=O)O)C(F)(F)F
Tpsa:
50.44
Logp:
3.1498
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1