CS-0541655
3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Manufacturer: ChemScene
CAS Number: 2102195-39-9
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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
C₁₃H₁₇BN₂O₃
Molecular Weight
260.10
Synonyms
None
SMILES
O=C1NCC2=NC=C(B3OC(C)(C(C)(C)O3)C)C=C12
Tpsa
60.45
Logp
0.6242
H Acceptors
4
H Donors
1
Rotatable Bonds
1
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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: C₁₃H₁₇BN₂O₃
Molecular Weight: 260.10
Synonyms: None
SMILES: O=C1NCC2=NC=C(B3OC(C)(C(C)(C)O3)C)C=C12
Tpsa: 60.45
Logp: 0.6242
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:
C₁₃H₁₇BN₂O₃
Molecular Weight:
260.10
Synonyms:
None
SMILES:
O=C1NCC2=NC=C(B3OC(C)(C(C)(C)O3)C)C=C12
Tpsa:
60.45
Logp:
0.6242
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₇BrN₂O₂
Molecular Weight: 219.04
Synonyms: None
SMILES: O=C(C1=C(Br)N(C)C=N1)OC
Tpsa: 44.12
Logp: 0.9692
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₇BrN₂O₂
Molecular Weight:
219.04
Synonyms:
None
SMILES:
O=C(C1=C(Br)N(C)C=N1)OC
Tpsa:
44.12
Logp:
0.9692
H Acceptors:
4
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: C₈H₈ClNO₃
Molecular Weight: 201.61
Synonyms: None
SMILES: O=C(C1=CC(OC)=C(C(N)=C1)Cl)O
Tpsa: 72.55
Logp: 1.629
H Acceptors: 3
H Donors: 2
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:
C₈H₈ClNO₃
Molecular Weight:
201.61
Synonyms:
None
SMILES:
O=C(C1=CC(OC)=C(C(N)=C1)Cl)O
Tpsa:
72.55
Logp:
1.629
H Acceptors:
3
H Donors:
2
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: C₁₇H₂₅ClN₂O₄
Molecular Weight: 356.84
Synonyms: ethyl (S)-2-(1-((tert-butoxycarbonyl)amino)-2-methylpropyl)-5-chloronicotinate
SMILES: CC(C)(C)OC(N[C@H](C1=C(C=C(C=N1)Cl)C(OCC)=O)C(C)C)=O
Tpsa: 77.52
Logp: 4.1335
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₅ClN₂O₄
Molecular Weight:
356.84
Synonyms:
ethyl (S)-2-(1-((tert-butoxycarbonyl)amino)-2-methylpropyl)-5-chloronicotinate
SMILES:
CC(C)(C)OC(N[C@H](C1=C(C=C(C=N1)Cl)C(OCC)=O)C(C)C)=O
Tpsa:
77.52
Logp:
4.1335
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5