CS-1065647
Tert-butyl 3-isobutyl-5-methoxy-1H-pyrazole-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2625975-19-9
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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
C₁₃H₂₂N₂O₃
Molecular Weight
254.33
Synonyms
None
SMILES
O=C(OC(C)(C)C)N1N=C(C=C1OC)CC(C)C
Tpsa
53.35
Logp
2.8734
H Acceptors
5
H Donors
0
Rotatable Bonds
3
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: C₁₃H₂₂N₂O₃
Molecular Weight: 254.33
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1N=C(C=C1OC)CC(C)C
Tpsa: 53.35
Logp: 2.8734
H Acceptors: 5
H Donors: 0
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:
C₁₃H₂₂N₂O₃
Molecular Weight:
254.33
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1N=C(C=C1OC)CC(C)C
Tpsa:
53.35
Logp:
2.8734
H Acceptors:
5
H Donors:
0
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: C₁₃H₁₁F₂NO₂
Molecular Weight: 251.23
Synonyms: None
SMILES: O=C(O)C1=NC=2C=C(F)C=C(F)C2C(=C1CC)C
Tpsa: 50.19
Logp: 3.08202
H Acceptors: 2
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:
C₁₃H₁₁F₂NO₂
Molecular Weight:
251.23
Synonyms:
None
SMILES:
O=C(O)C1=NC=2C=C(F)C=C(F)C2C(=C1CC)C
Tpsa:
50.19
Logp:
3.08202
H Acceptors:
2
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: C₁₃H₁₂ClNO₃
Molecular Weight: 265.69
Synonyms: None
SMILES: O=C(OC)COCC1=NC=2C=CC(Cl)=CC2C=C1
Tpsa: 48.42
Logp: 2.5778
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂ClNO₃
Molecular Weight:
265.69
Synonyms:
None
SMILES:
O=C(OC)COCC1=NC=2C=CC(Cl)=CC2C=C1
Tpsa:
48.42
Logp:
2.5778
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₉ClN₂O₂
Molecular Weight: 248.67
Synonyms: None
SMILES: O=C(OC)C=1C(C#CC)=C(Cl)C=C2NN=CC21
Tpsa: 54.98
Logp: 2.3743
H Acceptors: 3
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:
C₁₂H₉ClN₂O₂
Molecular Weight:
248.67
Synonyms:
None
SMILES:
O=C(OC)C=1C(C#CC)=C(Cl)C=C2NN=CC21
Tpsa:
54.98
Logp:
2.3743
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1