CS-1068087
1-(Tert-butyl)-5-chloro-3-(methylthio)-1H-pyrazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2841514-53-0
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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
C₉H₁₃ClN₂O₂S
Molecular Weight
248.73
Synonyms
None
SMILES
O=C(O)C=1C(=NN(C1Cl)C(C)(C)C)SC
Tpsa
55.12
Logp
2.7116
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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: C₉H₁₃ClN₂O₂S
Molecular Weight: 248.73
Synonyms: None
SMILES: O=C(O)C=1C(=NN(C1Cl)C(C)(C)C)SC
Tpsa: 55.12
Logp: 2.7116
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:
C₉H₁₃ClN₂O₂S
Molecular Weight:
248.73
Synonyms:
None
SMILES:
O=C(O)C=1C(=NN(C1Cl)C(C)(C)C)SC
Tpsa:
55.12
Logp:
2.7116
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: C₁₄H₁₉FN₂O₂
Molecular Weight: 266.31
Synonyms: None
SMILES: C(OCC1=CC=CC=C1)(=O)N2CC(N[C@H](CF)C)C2
Tpsa: 41.57
Logp: 1.955
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₉FN₂O₂
Molecular Weight:
266.31
Synonyms:
None
SMILES:
C(OCC1=CC=CC=C1)(=O)N2CC(N[C@H](CF)C)C2
Tpsa:
41.57
Logp:
1.955
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₇BrN₂O
Molecular Weight: 261.16
Synonyms: None
SMILES: BrC1=C(C(=NN1CC(O)CC)CC)C
Tpsa: 38.05
Logp: 2.28732
H Acceptors: 3
H Donors: 1
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:
C₁₀H₁₇BrN₂O
Molecular Weight:
261.16
Synonyms:
None
SMILES:
BrC1=C(C(=NN1CC(O)CC)CC)C
Tpsa:
38.05
Logp:
2.28732
H Acceptors:
3
H Donors:
1
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: C₇H₇F₄N₃O₂
Molecular Weight: 241.14
Synonyms: None
SMILES: O=C(O)C1=C(N)N(N=C1C(F)(F)F)CCF
Tpsa: 81.14
Logp: 1.1518
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:
C₇H₇F₄N₃O₂
Molecular Weight:
241.14
Synonyms:
None
SMILES:
O=C(O)C1=C(N)N(N=C1C(F)(F)F)CCF
Tpsa:
81.14
Logp:
1.1518
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3