CS-0643305
1-(1,1-Dimethylethyl) 3-methyl 7-chloro-1H-pyrazolo[4,3-d]pyrimidine-1,3-dicarboxylate
Manufacturer: ChemScene
CAS Number: 2839502-26-8
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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
C₁₂H₁₃ClN₄O₄
Molecular Weight
312.71
Synonyms
None
SMILES
O=C(N1N=C(C(OC)=O)C2=NC=NC(Cl)=C21)OC(C)(C)C
Tpsa
96.2
Logp
2.0495
H Acceptors
8
H Donors
0
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: C₁₂H₁₃ClN₄O₄
Molecular Weight: 312.71
Synonyms: None
SMILES: O=C(N1N=C(C(OC)=O)C2=NC=NC(Cl)=C21)OC(C)(C)C
Tpsa: 96.2
Logp: 2.0495
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:
C₁₂H₁₃ClN₄O₄
Molecular Weight:
312.71
Synonyms:
None
SMILES:
O=C(N1N=C(C(OC)=O)C2=NC=NC(Cl)=C21)OC(C)(C)C
Tpsa:
96.2
Logp:
2.0495
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: C₇H₇ClN₄
Molecular Weight: 182.61
Synonyms: None
SMILES: NC1=CN(C)C2=C(Cl)N=CN=C21
Tpsa: 56.73
Logp: 1.2039
H Acceptors: 4
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:
C₇H₇ClN₄
Molecular Weight:
182.61
Synonyms:
None
SMILES:
NC1=CN(C)C2=C(Cl)N=CN=C21
Tpsa:
56.73
Logp:
1.2039
H Acceptors:
4
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: C₂₄H₂₂N₂O₂
Molecular Weight: 370.44
Synonyms: None
SMILES: O=C(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)NC4=CC=CC5=C4CNCC5
Tpsa: 50.36
Logp: 4.6933
H Acceptors: 3
H Donors: 2
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:
C₂₄H₂₂N₂O₂
Molecular Weight:
370.44
Synonyms:
None
SMILES:
O=C(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)NC4=CC=CC5=C4CNCC5
Tpsa:
50.36
Logp:
4.6933
H Acceptors:
3
H Donors:
2
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: C₁₉H₂₇BN₂O₅
Molecular Weight: 374.24
Synonyms: None
SMILES: O=C(N(CC1=C2C(N)=CC=C1B3OC(C)(C)C(C)(C)O3)C2=O)OC(C)(C)C
Tpsa: 91.09
Logp: 2.4589
H Acceptors: 6
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:
C₁₉H₂₇BN₂O₅
Molecular Weight:
374.24
Synonyms:
None
SMILES:
O=C(N(CC1=C2C(N)=CC=C1B3OC(C)(C)C(C)(C)O3)C2=O)OC(C)(C)C
Tpsa:
91.09
Logp:
2.4589
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
1