CS-0655506
1-Chloro-5-nitro-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline
Manufacturer: ChemScene
CAS Number: 2226673-79-4
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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
C₁₅H₁₆BClN₂O₄
Molecular Weight
334.56
Synonyms
None
SMILES
CC1(C)C(C)(C)OB(C2=CC3=C(C([N+]([O-])=O)=C2)C=CN=C3Cl)O1
Tpsa
74.49
Logp
3.0956
H Acceptors
5
H Donors
0
Rotatable Bonds
2
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: C₁₅H₁₆BClN₂O₄
Molecular Weight: 334.56
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CC3=C(C([N+]([O-])=O)=C2)C=CN=C3Cl)O1
Tpsa: 74.49
Logp: 3.0956
H Acceptors: 5
H Donors: 0
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:
C₁₅H₁₆BClN₂O₄
Molecular Weight:
334.56
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CC3=C(C([N+]([O-])=O)=C2)C=CN=C3Cl)O1
Tpsa:
74.49
Logp:
3.0956
H Acceptors:
5
H Donors:
0
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: C₈H₇BrClNO₂
Molecular Weight: 264.50
Synonyms: None
SMILES: O=C(C1=C(Br)C=NC=C1Cl)OCC
Tpsa: 39.19
Logp: 2.6742
H Acceptors: 3
H Donors: 0
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:
C₈H₇BrClNO₂
Molecular Weight:
264.50
Synonyms:
None
SMILES:
O=C(C1=C(Br)C=NC=C1Cl)OCC
Tpsa:
39.19
Logp:
2.6742
H Acceptors:
3
H Donors:
0
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: C₁₁H₁₈N₂
Molecular Weight: 178.27
Synonyms: None
SMILES: CC(C1=C(CCC2(C)C)C2=NN1)C
Tpsa: 28.68
Logp: 2.7569
H Acceptors: 1
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:
C₁₁H₁₈N₂
Molecular Weight:
178.27
Synonyms:
None
SMILES:
CC(C1=C(CCC2(C)C)C2=NN1)C
Tpsa:
28.68
Logp:
2.7569
H Acceptors:
1
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: C₉H₅ClN₂O₃
Molecular Weight: 224.60
Synonyms: None
SMILES: OC1=CC2=C(C([N+]([O-])=O)=C1)C=CN=C2Cl
Tpsa: 76.26
Logp: 2.502
H Acceptors: 4
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:
C₉H₅ClN₂O₃
Molecular Weight:
224.60
Synonyms:
None
SMILES:
OC1=CC2=C(C([N+]([O-])=O)=C1)C=CN=C2Cl
Tpsa:
76.26
Logp:
2.502
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1