CS-1101028
Imidodicarbonic acid, N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-isoquinolinyl]-, C,C′-bis(1,1-dimethylethyl) ester
Manufacturer: ChemScene
CAS Number: 3033048-04-0
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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=C(B2OC(C)(C)C(C)(C)O2)C3=C1C=CC=C3)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=C(B2OC(C)(C)C(C)(C)O2)C3=C1C=CC=C3)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=C(B2OC(C)(C)C(C)(C)O2)C3=C1C=CC=C3)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: C₈H₁₀ClN₃O₂
Molecular Weight: 215.64
Synonyms: None
SMILES: O=C1NC2=C(C(N)=CN=C2OC1)C.Cl
Tpsa: 77.24
Logp: 0.72492
H Acceptors: 4
H Donors: 2
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:
C₈H₁₀ClN₃O₂
Molecular Weight:
215.64
Synonyms:
None
SMILES:
O=C1NC2=C(C(N)=CN=C2OC1)C.Cl
Tpsa:
77.24
Logp:
0.72492
H Acceptors:
4
H Donors:
2
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: C₁₃H₁₇BrN₂O₄
Molecular Weight: 345.19
Synonyms: None
SMILES: O=C(N1C2=C(OC)C(Br)=CN=C2OCC1)OC(C)(C)C
Tpsa: 60.89
Logp: 2.9866
H Acceptors: 5
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:
C₁₃H₁₇BrN₂O₄
Molecular Weight:
345.19
Synonyms:
None
SMILES:
O=C(N1C2=C(OC)C(Br)=CN=C2OCC1)OC(C)(C)C
Tpsa:
60.89
Logp:
2.9866
H Acceptors:
5
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: C₁₁H₁₃ClO₃
Molecular Weight: 228.67
Synonyms: None
SMILES: O=C(OC)CCC1=CC=C(Cl)C=C1CO
Tpsa: 46.53
Logp: 1.9379
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃ClO₃
Molecular Weight:
228.67
Synonyms:
None
SMILES:
O=C(OC)CCC1=CC=C(Cl)C=C1CO
Tpsa:
46.53
Logp:
1.9379
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4