CS-0676691
4-Bromo-2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 883898-95-1
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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
C₁₂H₁₃BBrNO₂
Molecular Weight
293.95
Synonyms
None
SMILES
B1(OCC(CO1)(C)C)C2=C(C=CC(=C2)Br)C#N
Tpsa
42.25
Logp
2.08898
H Acceptors
3
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 883898-95-1 | 4-BROMO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZONITRILE | A2B Chem | -- |
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: C₁₂H₁₃BBrNO₂
Molecular Weight: 293.95
Synonyms: None
SMILES: B1(OCC(CO1)(C)C)C2=C(C=CC(=C2)Br)C#N
Tpsa: 42.25
Logp: 2.08898
H Acceptors: 3
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:
C₁₂H₁₃BBrNO₂
Molecular Weight:
293.95
Synonyms:
None
SMILES:
B1(OCC(CO1)(C)C)C2=C(C=CC(=C2)Br)C#N
Tpsa:
42.25
Logp:
2.08898
H Acceptors:
3
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: C₁₈H₂₀N₂O₄
Molecular Weight: 328.36
Synonyms: None
SMILES: C1=CC=C(C=C1)CNC(=O)[C@@H]([C@H](C(=O)NCC2=CC=CC=C2)O)O
Tpsa: 98.66
Logp: 0.341
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₀N₂O₄
Molecular Weight:
328.36
Synonyms:
None
SMILES:
C1=CC=C(C=C1)CNC(=O)[C@@H]([C@H](C(=O)NCC2=CC=CC=C2)O)O
Tpsa:
98.66
Logp:
0.341
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₇N₃O
Molecular Weight: 137.14
Synonyms: None
SMILES: CC1=NN=C(C=C1)C(=O)N
Tpsa: 68.87
Logp: -0.11608
H Acceptors: 3
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:
C₆H₇N₃O
Molecular Weight:
137.14
Synonyms:
None
SMILES:
CC1=NN=C(C=C1)C(=O)N
Tpsa:
68.87
Logp:
-0.11608
H Acceptors:
3
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: C₆H₁₃N₃OS
Molecular Weight: 175.25
Synonyms: None
SMILES: C1CSCCN1C/C(=N/O)/N
Tpsa: 61.85
Logp: -0.2184
H Acceptors: 4
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:
C₆H₁₃N₃OS
Molecular Weight:
175.25
Synonyms:
None
SMILES:
C1CSCCN1C/C(=N/O)/N
Tpsa:
61.85
Logp:
-0.2184
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2