CS-0902138
7-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline-1-carbonitrile
Manufacturer: ChemScene
CAS Number: 1872407-77-6
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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
C₁₆H₁₇BN₂O₂
Molecular Weight
280.13
Synonyms
None
SMILES
N#CC1=NC=CC=2C=CC(=CC12)B3OC(C)(C)C(O3)(C)C
Tpsa
55.14
Logp
2.40568
H Acceptors
4
H Donors
0
Rotatable Bonds
1
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: C₁₆H₁₇BN₂O₂
Molecular Weight: 280.13
Synonyms: None
SMILES: N#CC1=NC=CC=2C=CC(=CC12)B3OC(C)(C)C(O3)(C)C
Tpsa: 55.14
Logp: 2.40568
H Acceptors: 4
H Donors: 0
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:
C₁₆H₁₇BN₂O₂
Molecular Weight:
280.13
Synonyms:
None
SMILES:
N#CC1=NC=CC=2C=CC(=CC12)B3OC(C)(C)C(O3)(C)C
Tpsa:
55.14
Logp:
2.40568
H Acceptors:
4
H Donors:
0
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: C₁₂H₉NO
Molecular Weight: 183.21
Synonyms: None
SMILES: O=C1C=2C(C#C)=CC=CC2C=CN1C
Tpsa: 22
Logp: 1.5198
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉NO
Molecular Weight:
183.21
Synonyms:
None
SMILES:
O=C1C=2C(C#C)=CC=CC2C=CN1C
Tpsa:
22
Logp:
1.5198
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD29761599
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀BrN
Molecular Weight: 236.11
Synonyms: None
SMILES: BrC1=CC=C(C2=NC(=CC=C12)C)C
Tpsa: 12.89
Logp: 3.61414
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD29761599
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀BrN
Molecular Weight:
236.11
Synonyms:
None
SMILES:
BrC1=CC=C(C2=NC(=CC=C12)C)C
Tpsa:
12.89
Logp:
3.61414
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₀BrNO₄
Molecular Weight: 312.12
Synonyms: None
SMILES: O=C(OC)C=1C(=O)N(C=2C=CC(Br)=CC2C1O)C
Tpsa: 68.53
Logp: 1.7932
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:
C₁₂H₁₀BrNO₄
Molecular Weight:
312.12
Synonyms:
None
SMILES:
O=C(OC)C=1C(=O)N(C=2C=CC(Br)=CC2C1O)C
Tpsa:
68.53
Logp:
1.7932
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1