CS-0926011
2-[7-Bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazol-3-yl]-, 1,3-bis(1,1-dimethylethyl) ester imidodicarbonic acid
Manufacturer: ChemScene
CAS Number: 3011842-78-4
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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
C₂₃H₃₃BBrN₃O₆
Molecular Weight
538.24
Synonyms
None
SMILES
O=C(OC(C)(C)C)N(C1=NNC2=C1C=C(B3OC(C)(C)C(C)(C)O3)C=C2Br)C(OC(C)(C)C)=O
Tpsa
102.98
Logp
5.3012
H Acceptors
7
H Donors
1
Rotatable Bonds
2
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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: C₂₃H₃₃BBrN₃O₆
Molecular Weight: 538.24
Synonyms: None
SMILES: O=C(OC(C)(C)C)N(C1=NNC2=C1C=C(B3OC(C)(C)C(C)(C)O3)C=C2Br)C(OC(C)(C)C)=O
Tpsa: 102.98
Logp: 5.3012
H Acceptors: 7
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:
C₂₃H₃₃BBrN₃O₆
Molecular Weight:
538.24
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N(C1=NNC2=C1C=C(B3OC(C)(C)C(C)(C)O3)C=C2Br)C(OC(C)(C)C)=O
Tpsa:
102.98
Logp:
5.3012
H Acceptors:
7
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: C₁₃H₁₇BBrN₃O₂
Molecular Weight: 338.01
Synonyms: None
SMILES: NC1=NNC2=C1C=C(B3OC(C)(C)C(C)(C)O3)C=C2Br
Tpsa: 73.16
Logp: 2.2068
H Acceptors: 4
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:
C₁₃H₁₇BBrN₃O₂
Molecular Weight:
338.01
Synonyms:
None
SMILES:
NC1=NNC2=C1C=C(B3OC(C)(C)C(C)(C)O3)C=C2Br
Tpsa:
73.16
Logp:
2.2068
H Acceptors:
4
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: C₁₃H₁₄BBrFNO₂
Molecular Weight: 325.97
Synonyms: None
SMILES: N#CC1=CC(B2OC(C)(C)C(C)(C)O2)=CC(Br)=C1F
Tpsa: 42.25
Logp: 2.75908
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:
C₁₃H₁₄BBrFNO₂
Molecular Weight:
325.97
Synonyms:
None
SMILES:
N#CC1=CC(B2OC(C)(C)C(C)(C)O2)=CC(Br)=C1F
Tpsa:
42.25
Logp:
2.75908
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₆ClNO
Molecular Weight: 165.66
Synonyms: None
SMILES: NCC1C(C)(C)OCC1.Cl
Tpsa: 35.25
Logp: 1.182
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₆ClNO
Molecular Weight:
165.66
Synonyms:
None
SMILES:
NCC1C(C)(C)OCC1.Cl
Tpsa:
35.25
Logp:
1.182
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1