CS-0882644
4-(Methoxycarbonyl)-2-(methylthio)pyrimidine-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2092628-15-2
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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
C₈H₈N₂O₄S
Molecular Weight
228.23
Synonyms
None
SMILES
O=C(C1=NC(SC)=NC=C1C(O)=O)OC
Tpsa
89.38
Logp
0.6833
H Acceptors
6
H Donors
1
Rotatable Bonds
3
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₈H₈N₂O₄S
Molecular Weight: 228.23
Synonyms: None
SMILES: O=C(C1=NC(SC)=NC=C1C(O)=O)OC
Tpsa: 89.38
Logp: 0.6833
H Acceptors: 6
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:
C₈H₈N₂O₄S
Molecular Weight:
228.23
Synonyms:
None
SMILES:
O=C(C1=NC(SC)=NC=C1C(O)=O)OC
Tpsa:
89.38
Logp:
0.6833
H Acceptors:
6
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: C₇H₂ClF₄IO
Molecular Weight: 340.44
Synonyms: None
SMILES: FC(F)(F)OC1=C(I)C=C(F)C(Cl)=C1
Tpsa: 9.23
Logp: 3.9823
H Acceptors: 1
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:
C₇H₂ClF₄IO
Molecular Weight:
340.44
Synonyms:
None
SMILES:
FC(F)(F)OC1=C(I)C=C(F)C(Cl)=C1
Tpsa:
9.23
Logp:
3.9823
H Acceptors:
1
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: C₉H₉NO₄
Molecular Weight: 195.17
Synonyms: None
SMILES: O=C(C1=NC=C(C(O)=O)C=C1C)OC
Tpsa: 76.49
Logp: 0.87482
H Acceptors: 4
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:
C₉H₉NO₄
Molecular Weight:
195.17
Synonyms:
None
SMILES:
O=C(C1=NC=C(C(O)=O)C=C1C)OC
Tpsa:
76.49
Logp:
0.87482
H Acceptors:
4
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: C₉H₆F₃NO₄
Molecular Weight: 249.14
Synonyms: None
SMILES: O=C(C1=NC=C(C(O)=O)C=C1C(F)(F)F)OC
Tpsa: 76.49
Logp: 1.5852
H Acceptors: 4
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:
C₉H₆F₃NO₄
Molecular Weight:
249.14
Synonyms:
None
SMILES:
O=C(C1=NC=C(C(O)=O)C=C1C(F)(F)F)OC
Tpsa:
76.49
Logp:
1.5852
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2