CS-0804812
(3,4,5-Tricyanophenyl)boronic acid
Manufacturer: ChemScene
CAS Number: 1561213-42-0
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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
C₉H₄BN₃O₂
Molecular Weight
196.96
Synonyms
None
SMILES
N#CC1=C(C#N)C(C#N)=CC(B(O)O)=C1
Tpsa
111.83
Logp
-1.01856
H Acceptors
5
H Donors
2
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: C₉H₄BN₃O₂
Molecular Weight: 196.96
Synonyms: None
SMILES: N#CC1=C(C#N)C(C#N)=CC(B(O)O)=C1
Tpsa: 111.83
Logp: -1.01856
H Acceptors: 5
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:
C₉H₄BN₃O₂
Molecular Weight:
196.96
Synonyms:
None
SMILES:
N#CC1=C(C#N)C(C#N)=CC(B(O)O)=C1
Tpsa:
111.83
Logp:
-1.01856
H Acceptors:
5
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: C₁₀H₁₆BN₃O₂
Molecular Weight: 221.06
Synonyms: None
SMILES: B(C1=CN=C(C=N1)N2CCCCC2C)(O)O
Tpsa: 69.48
Logp: -0.4648
H Acceptors: 5
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:
C₁₀H₁₆BN₃O₂
Molecular Weight:
221.06
Synonyms:
None
SMILES:
B(C1=CN=C(C=N1)N2CCCCC2C)(O)O
Tpsa:
69.48
Logp:
-0.4648
H Acceptors:
5
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: C₈H₁₂BN₃O₃
Molecular Weight: 209.01
Synonyms: None
SMILES: B(C1=NC(=NC=C1)N2CCOCC2)(O)O
Tpsa: 78.71
Logp: -2.007
H Acceptors: 6
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:
C₈H₁₂BN₃O₃
Molecular Weight:
209.01
Synonyms:
None
SMILES:
B(C1=NC(=NC=C1)N2CCOCC2)(O)O
Tpsa:
78.71
Logp:
-2.007
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD07787226
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₇F₃N₂S
Molecular Weight: 208.20
Synonyms: None
SMILES: C1=CC(=CC(=C1)SC(F)(F)F)NN
Tpsa: 38.05
Logp: 2.5841
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD07787226
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₇F₃N₂S
Molecular Weight:
208.20
Synonyms:
None
SMILES:
C1=CC(=CC(=C1)SC(F)(F)F)NN
Tpsa:
38.05
Logp:
2.5841
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2