CS-1101090
Imidodicarbonic acid, N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-isoquinolinyl]-, C,C′-bis(1,1-dimethylethyl) ester
Manufacturer: ChemScene
CAS Number: 3033048-05-1
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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
C₂₅H₃₅BN₂O₆
Molecular Weight
470.37
Synonyms
None
SMILES
O=C(OC(C)(C)C)N(C1=NC=CC2=C1C=CC=C2B3OC(C)(C)C(C)(C)O3)C(OC(C)(C)C)=O
Tpsa
87.19
Logp
5.2106
H Acceptors
7
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: C₂₅H₃₅BN₂O₆
Molecular Weight: 470.37
Synonyms: None
SMILES: O=C(OC(C)(C)C)N(C1=NC=CC2=C1C=CC=C2B3OC(C)(C)C(C)(C)O3)C(OC(C)(C)C)=O
Tpsa: 87.19
Logp: 5.2106
H Acceptors: 7
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:
C₂₅H₃₅BN₂O₆
Molecular Weight:
470.37
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N(C1=NC=CC2=C1C=CC=C2B3OC(C)(C)C(C)(C)O3)C(OC(C)(C)C)=O
Tpsa:
87.19
Logp:
5.2106
H Acceptors:
7
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: C₉H₁₀BrClF₃N
Molecular Weight: 304.53
Synonyms: None
SMILES: FC(F)(F)C1=CC(CNC)=CC=C1Br.Cl
Tpsa: 12.03
Logp: 3.6091
H Acceptors: 1
H Donors: 1
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:
C₉H₁₀BrClF₃N
Molecular Weight:
304.53
Synonyms:
None
SMILES:
FC(F)(F)C1=CC(CNC)=CC=C1Br.Cl
Tpsa:
12.03
Logp:
3.6091
H Acceptors:
1
H Donors:
1
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: C₈H₆BrClF₂
Molecular Weight: 255.49
Synonyms: None
SMILES: CC1=C(Cl)C(Br)=CC(C(F)F)=C1
Tpsa: 0
Logp: 4.34852
H Acceptors: 0
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:
C₈H₆BrClF₂
Molecular Weight:
255.49
Synonyms:
None
SMILES:
CC1=C(Cl)C(Br)=CC(C(F)F)=C1
Tpsa:
0
Logp:
4.34852
H Acceptors:
0
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: C₉H₉BrF₂
Molecular Weight: 235.07
Synonyms: None
SMILES: CC1=C(C)C(C(F)F)=CC(Br)=C1
Tpsa: 0
Logp: 4.00354
H Acceptors: 0
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:
C₉H₉BrF₂
Molecular Weight:
235.07
Synonyms:
None
SMILES:
CC1=C(C)C(C(F)F)=CC(Br)=C1
Tpsa:
0
Logp:
4.00354
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
1