CS-1136658
N-(5-Bromo-4-fluoro-2-pyridinyl) imidodicarbonic acid C,C'-bis(1,1-dimethylethyl) ester
Manufacturer: ChemScene
CAS Number: 3041032-57-6
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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
C₁₅H₂₀BrFN₂O₄
Molecular Weight
391.23
Synonyms
None
SMILES
O=C(OC(C)(C)C)N(C1=NC=C(Br)C(F)=C1)C(OC(C)(C)C)=O
Tpsa
68.73
Logp
4.6598
H Acceptors
5
H Donors
0
Rotatable Bonds
1
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: C₁₅H₂₀BrFN₂O₄
Molecular Weight: 391.23
Synonyms: None
SMILES: O=C(OC(C)(C)C)N(C1=NC=C(Br)C(F)=C1)C(OC(C)(C)C)=O
Tpsa: 68.73
Logp: 4.6598
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:
C₁₅H₂₀BrFN₂O₄
Molecular Weight:
391.23
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N(C1=NC=C(Br)C(F)=C1)C(OC(C)(C)C)=O
Tpsa:
68.73
Logp:
4.6598
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: C₂₉H₂₄O₂
Molecular Weight: 404.50
Synonyms: None
SMILES: OC1=CC(C2=CC=CC=C2)=CC3=C1[C@]4(CCC5=C4C(O)=CC(C6=CC=CC=C6)=C5)CC3
Tpsa: 40.46
Logp: 6.6103
H Acceptors: 2
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:
C₂₉H₂₄O₂
Molecular Weight:
404.50
Synonyms:
None
SMILES:
OC1=CC(C2=CC=CC=C2)=CC3=C1[C@]4(CCC5=C4C(O)=CC(C6=CC=CC=C6)=C5)CC3
Tpsa:
40.46
Logp:
6.6103
H Acceptors:
2
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: C₈H₈BrNO₃
Molecular Weight: 246.06
Synonyms: None
SMILES: O=C(O)CC1=NC=C(Br)C(OC)=C1
Tpsa: 59.42
Logp: 1.4798
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈BrNO₃
Molecular Weight:
246.06
Synonyms:
None
SMILES:
O=C(O)CC1=NC=C(Br)C(OC)=C1
Tpsa:
59.42
Logp:
1.4798
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₁F₃O
Molecular Weight: 180.17
Synonyms: None
SMILES: OC(CCC1)(C(F)(F)F)C21CC2
Tpsa: 20.23
Logp: 2.2439
H Acceptors: 1
H Donors: 1
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:
C₈H₁₁F₃O
Molecular Weight:
180.17
Synonyms:
None
SMILES:
OC(CCC1)(C(F)(F)F)C21CC2
Tpsa:
20.23
Logp:
2.2439
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0