CS-0612221
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1H-pyrrolo[2,3-b]pyridine-2-carbonitrile
Manufacturer: ChemScene
CAS Number: 2267318-04-5
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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
C₂₁H₂₂BN₃O₄S
Molecular Weight
423.29
Synonyms
None
SMILES
N#CC1=CC2=C(B3OC(C)(C)C(C)(C)O3)C=CN=C2N1S(=O)(C4=CC=C(C)C=C4)=O
Tpsa
94.21
Logp
2.7526
H Acceptors
7
H Donors
0
Rotatable Bonds
3
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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
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: C₂₁H₂₂BN₃O₄S
Molecular Weight: 423.29
Synonyms: None
SMILES: N#CC1=CC2=C(B3OC(C)(C)C(C)(C)O3)C=CN=C2N1S(=O)(C4=CC=C(C)C=C4)=O
Tpsa: 94.21
Logp: 2.7526
H Acceptors: 7
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:
C₂₁H₂₂BN₃O₄S
Molecular Weight:
423.29
Synonyms:
None
SMILES:
N#CC1=CC2=C(B3OC(C)(C)C(C)(C)O3)C=CN=C2N1S(=O)(C4=CC=C(C)C=C4)=O
Tpsa:
94.21
Logp:
2.7526
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: MFCD29087247
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₄O₃
Molecular Weight: 170.21
Synonyms: None
SMILES: O=C(OC(C)(C)C)COCC#C
Tpsa: 35.53
Logp: 0.9779
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
MFCD29087247
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₄O₃
Molecular Weight:
170.21
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)COCC#C
Tpsa:
35.53
Logp:
0.9779
H Acceptors:
3
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: C₁₃H₁₆BClN₂O₂
Molecular Weight: 278.54
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=C3C(NC=C3)=NC(Cl)=C2)O1
Tpsa: 47.14
Logp: 2.5155
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:
C₁₃H₁₆BClN₂O₂
Molecular Weight:
278.54
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=C3C(NC=C3)=NC(Cl)=C2)O1
Tpsa:
47.14
Logp:
2.5155
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: C₁₁H₁₈BN₃O₂
Molecular Weight: 235.09
Synonyms: None
SMILES: CC(C(C)(O1)C)(OB1C(C=CN=C2N)=C2N)C
Tpsa: 83.39
Logp: 0.5452
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:
C₁₁H₁₈BN₃O₂
Molecular Weight:
235.09
Synonyms:
None
SMILES:
CC(C(C)(O1)C)(OB1C(C=CN=C2N)=C2N)C
Tpsa:
83.39
Logp:
0.5452
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
1