CS-0892306
tert-Butyl 3-(difluoromethyl)-5-hydroxy-1H-pyrazole-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2957830-68-9
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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
C₉H₁₂F₂N₂O₃
Molecular Weight
234.20
Synonyms
None
SMILES
O=C(N1N=C(C(F)F)C=C1O)OC(C)(C)C
Tpsa
64.35
Logp
2.3095
H Acceptors
5
H Donors
1
Rotatable Bonds
1
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: C₉H₁₂F₂N₂O₃
Molecular Weight: 234.20
Synonyms: None
SMILES: O=C(N1N=C(C(F)F)C=C1O)OC(C)(C)C
Tpsa: 64.35
Logp: 2.3095
H Acceptors: 5
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:
C₉H₁₂F₂N₂O₃
Molecular Weight:
234.20
Synonyms:
None
SMILES:
O=C(N1N=C(C(F)F)C=C1O)OC(C)(C)C
Tpsa:
64.35
Logp:
2.3095
H Acceptors:
5
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: C₁₆H₁₅F₃O₅S
Molecular Weight: 376.35
Synonyms: None
SMILES: O=S(C(F)(F)F)(OC1=C2C3=C(CCC3)C=CC2=CC(OCOC)=C1)=O
Tpsa: 61.83
Logp: 3.5396
H Acceptors: 5
H Donors: 0
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:
C₁₆H₁₅F₃O₅S
Molecular Weight:
376.35
Synonyms:
None
SMILES:
O=S(C(F)(F)F)(OC1=C2C3=C(CCC3)C=CC2=CC(OCOC)=C1)=O
Tpsa:
61.83
Logp:
3.5396
H Acceptors:
5
H Donors:
0
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: C₁₅H₁₆O₃
Molecular Weight: 244.29
Synonyms: None
SMILES: OC1=CC(OCOC)=C2C3=C(CCC3)C=CC2=C1
Tpsa: 38.69
Logp: 3.0168
H Acceptors: 3
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:
C₁₅H₁₆O₃
Molecular Weight:
244.29
Synonyms:
None
SMILES:
OC1=CC(OCOC)=C2C3=C(CCC3)C=CC2=C1
Tpsa:
38.69
Logp:
3.0168
H Acceptors:
3
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: C₁₇H₂₂Br₂N₂O₆
Molecular Weight: 510.17
Synonyms: None
SMILES: O=C(OC(C)(C)C)N(C1=CC(Br)=C(CBr)C=C1[N+]([O-])=O)C(OC(C)(C)C)=O
Tpsa: 98.98
Logp: 5.9288
H Acceptors: 6
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:
C₁₇H₂₂Br₂N₂O₆
Molecular Weight:
510.17
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N(C1=CC(Br)=C(CBr)C=C1[N+]([O-])=O)C(OC(C)(C)C)=O
Tpsa:
98.98
Logp:
5.9288
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3