CS-1054212
3-(Fluoromethyl)-1-methyl-1H-pyrazole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1347255-92-8
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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
C₆H₇FN₂O₂
Molecular Weight
158.13
Synonyms
None
SMILES
O=C(C1=CC(CF)=NN1C)O
Tpsa
55.12
Logp
0.5878
H Acceptors
3
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: C₆H₇FN₂O₂
Molecular Weight: 158.13
Synonyms: None
SMILES: O=C(C1=CC(CF)=NN1C)O
Tpsa: 55.12
Logp: 0.5878
H Acceptors: 3
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:
C₆H₇FN₂O₂
Molecular Weight:
158.13
Synonyms:
None
SMILES:
O=C(C1=CC(CF)=NN1C)O
Tpsa:
55.12
Logp:
0.5878
H Acceptors:
3
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: C₇H₁₁N₃O₂
Molecular Weight: 169.18
Synonyms: None
SMILES: O=C(C1=NN(C)C(C)=C1CN)O
Tpsa: 81.14
Logp: -0.11458
H Acceptors: 4
H Donors: 2
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:
C₇H₁₁N₃O₂
Molecular Weight:
169.18
Synonyms:
None
SMILES:
O=C(C1=NN(C)C(C)=C1CN)O
Tpsa:
81.14
Logp:
-0.11458
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₄BF₂NO₂
Molecular Weight: 241.04
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CN=C(F)C=C2F)O1
Tpsa: 31.35
Logp: 1.659
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄BF₂NO₂
Molecular Weight:
241.04
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CN=C(F)C=C2F)O1
Tpsa:
31.35
Logp:
1.659
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₂O₆
Molecular Weight: 288.25
Synonyms: None
SMILES: O=C1OC2=C(OCCCC(O)=O)C3=C(C=CO3)C=C2C=C1
Tpsa: 89.88
Logp: 2.7828
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₂O₆
Molecular Weight:
288.25
Synonyms:
None
SMILES:
O=C1OC2=C(OCCCC(O)=O)C3=C(C=CO3)C=C2C=C1
Tpsa:
89.88
Logp:
2.7828
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5