CS-1173251
Ethyl 5-(2-hydroxypropan-2-yl)-4-iodo-1H-pyrazole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 3046128-82-6
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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
C₉H₁₃IN₂O₃
Molecular Weight
324.12
Synonyms
None
SMILES
O=C(C1=NNC(C(C)(O)C)=C1I)OCC
Tpsa
75.21
Logp
1.4184
H Acceptors
4
H Donors
2
Rotatable Bonds
3
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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: C₉H₁₃IN₂O₃
Molecular Weight: 324.12
Synonyms: None
SMILES: O=C(C1=NNC(C(C)(O)C)=C1I)OCC
Tpsa: 75.21
Logp: 1.4184
H Acceptors: 4
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:
C₉H₁₃IN₂O₃
Molecular Weight:
324.12
Synonyms:
None
SMILES:
O=C(C1=NNC(C(C)(O)C)=C1I)OCC
Tpsa:
75.21
Logp:
1.4184
H Acceptors:
4
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: C₁₆H₃₀BNO₄
Molecular Weight: 311.22
Synonyms: None
SMILES: O=C(OC(C)(C)C)NC(C)(C)/C=C/B1OC(C)(C)C(C)(C)O1
Tpsa: 56.79
Logp: 3.4773
H Acceptors: 4
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:
C₁₆H₃₀BNO₄
Molecular Weight:
311.22
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NC(C)(C)/C=C/B1OC(C)(C)C(C)(C)O1
Tpsa:
56.79
Logp:
3.4773
H Acceptors:
4
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: C₉H₆BrF₂NO₂
Molecular Weight: 278.05
Synonyms: None
SMILES: O=C1NC2=CC(C(F)F)=C(Br)C=C2OC1
Tpsa: 38.33
Logp: 2.7176
H Acceptors: 2
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:
C₉H₆BrF₂NO₂
Molecular Weight:
278.05
Synonyms:
None
SMILES:
O=C1NC2=CC(C(F)F)=C(Br)C=C2OC1
Tpsa:
38.33
Logp:
2.7176
H Acceptors:
2
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: C₈H₁₀ClF₂N₃O₂
Molecular Weight: 253.63
Synonyms: None
SMILES: COC1=C2C(CNC2)=NC(OC(F)F)=N1.Cl
Tpsa: 56.27
Logp: 1.1116
H Acceptors: 5
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:
C₈H₁₀ClF₂N₃O₂
Molecular Weight:
253.63
Synonyms:
None
SMILES:
COC1=C2C(CNC2)=NC(OC(F)F)=N1.Cl
Tpsa:
56.27
Logp:
1.1116
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3