CS-0806757
(1-(tert-Butoxycarbonyl)-7-cyano-1H-indol-2-yl)boronic acid
Manufacturer: ChemScene
CAS Number: 1445797-33-0
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Purity
98%
MDL No
MFCD28899777
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₄H₁₅BN₂O₄
Molecular Weight
286.09
Synonyms
None
SMILES
O=C(N1C(B(O)O)=CC2=C1C(C#N)=CC=C2)OC(C)(C)C
Tpsa
95.48
Logp
0.97598
H Acceptors
6
H Donors
2
Rotatable Bonds
1
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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: MFCD28899777
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₅BN₂O₄
Molecular Weight: 286.09
Synonyms: None
SMILES: O=C(N1C(B(O)O)=CC2=C1C(C#N)=CC=C2)OC(C)(C)C
Tpsa: 95.48
Logp: 0.97598
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD28899777
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₅BN₂O₄
Molecular Weight:
286.09
Synonyms:
None
SMILES:
O=C(N1C(B(O)O)=CC2=C1C(C#N)=CC=C2)OC(C)(C)C
Tpsa:
95.48
Logp:
0.97598
H Acceptors:
6
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: C₁₆H₂₃BO₄
Molecular Weight: 290.16
Synonyms: None
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)OC(C)C)C=O
Tpsa: 44.76
Logp: 2.5855
H Acceptors: 4
H Donors: 0
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:
C₁₆H₂₃BO₄
Molecular Weight:
290.16
Synonyms:
None
SMILES:
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)OC(C)C)C=O
Tpsa:
44.76
Logp:
2.5855
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD28886240
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₄BrF₃N₂O₄
Molecular Weight: 317.02
Synonyms: None
SMILES: FC(F)(F)OC1=CN=C(OC)C([N+]([O-])=O)=C1Br
Tpsa: 74.49
Logp: 2.6595
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD28886240
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₄BrF₃N₂O₄
Molecular Weight:
317.02
Synonyms:
None
SMILES:
FC(F)(F)OC1=CN=C(OC)C([N+]([O-])=O)=C1Br
Tpsa:
74.49
Logp:
2.6595
H Acceptors:
5
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: C₄H₉BO₂
Molecular Weight: 99.92
Synonyms: None
SMILES: C(\B(O)O)=C\CC
Tpsa: 40.46
Logp: -0.0354
H Acceptors: 2
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:
C₄H₉BO₂
Molecular Weight:
99.92
Synonyms:
None
SMILES:
C(\B(O)O)=C\CC
Tpsa:
40.46
Logp:
-0.0354
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2