CS-0646928
Methyl 3-bromo-6-[(1E)-3-ethoxy-3-oxo-1-propen-1-yl]-2-oxo-1(2H)-pyridineacetate
Manufacturer: ChemScene
CAS Number: 2648985-65-1
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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
C₁₃H₁₄BrNO₅
Molecular Weight
344.16
Synonyms
None
SMILES
O=C(OC)CN1C(/C=C/C(OCC)=O)=CC=C(Br)C1=O
Tpsa
74.6
Logp
1.3601
H Acceptors
6
H Donors
0
Rotatable Bonds
5
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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: C₁₃H₁₄BrNO₅
Molecular Weight: 344.16
Synonyms: None
SMILES: O=C(OC)CN1C(/C=C/C(OCC)=O)=CC=C(Br)C1=O
Tpsa: 74.6
Logp: 1.3601
H Acceptors: 6
H Donors: 0
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:
C₁₃H₁₄BrNO₅
Molecular Weight:
344.16
Synonyms:
None
SMILES:
O=C(OC)CN1C(/C=C/C(OCC)=O)=CC=C(Br)C1=O
Tpsa:
74.6
Logp:
1.3601
H Acceptors:
6
H Donors:
0
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: C₂₂H₂₉BrIN₃O₆
Molecular Weight: 638.29
Synonyms: None
SMILES: O=C(N1C(I)=CC2=NC(N(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O)=C(Br)C=C21)OC(C)(C)C
Tpsa: 99.96
Logp: 6.8632
H Acceptors: 8
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:
C₂₂H₂₉BrIN₃O₆
Molecular Weight:
638.29
Synonyms:
None
SMILES:
O=C(N1C(I)=CC2=NC(N(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O)=C(Br)C=C21)OC(C)(C)C
Tpsa:
99.96
Logp:
6.8632
H Acceptors:
8
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: C₂₃H₃₀O₂Si
Molecular Weight: 366.57
Synonyms: None
SMILES: O=C[C@H]1CC[C@H](O[Si](C2=CC=CC=C2)(C(C)(C)C)C3=CC=CC=C3)CC1
Tpsa: 26.3
Logp: 4.3207
H Acceptors: 2
H Donors: 0
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:
C₂₃H₃₀O₂Si
Molecular Weight:
366.57
Synonyms:
None
SMILES:
O=C[C@H]1CC[C@H](O[Si](C2=CC=CC=C2)(C(C)(C)C)C3=CC=CC=C3)CC1
Tpsa:
26.3
Logp:
4.3207
H Acceptors:
2
H Donors:
0
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: C₁₆H₁₇BrN₄O
Molecular Weight: 361.24
Synonyms: None
SMILES: NCC1=CC2=NC(NCC3=CC=C(OC)C=C3)=C(Br)C=C2N1
Tpsa: 75.96
Logp: 3.4048
H Acceptors: 4
H Donors: 3
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:
C₁₆H₁₇BrN₄O
Molecular Weight:
361.24
Synonyms:
None
SMILES:
NCC1=CC2=NC(NCC3=CC=C(OC)C=C3)=C(Br)C=C2N1
Tpsa:
75.96
Logp:
3.4048
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
5