CS-1036344
3-(Sec-butyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1862897-21-9
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₁₄N₂O₂
Molecular Weight
182.22
Synonyms
None
SMILES
O=C(O)C1=CN(N=C1C(C)CC)C
Tpsa
55.12
Logp
1.6318
H Acceptors
3
H Donors
1
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₄N₂O₂
Molecular Weight: 182.22
Synonyms: None
SMILES: O=C(O)C1=CN(N=C1C(C)CC)C
Tpsa: 55.12
Logp: 1.6318
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₄N₂O₂
Molecular Weight:
182.22
Synonyms:
None
SMILES:
O=C(O)C1=CN(N=C1C(C)CC)C
Tpsa:
55.12
Logp:
1.6318
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₆ClN₃O₂S
Molecular Weight: 207.64
Synonyms: None
SMILES: O=S(=O)(N)CC1=NC(Cl)=NC=C1
Tpsa: 85.94
Logp: -0.0815
H Acceptors: 4
H Donors: 1
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:
C₅H₆ClN₃O₂S
Molecular Weight:
207.64
Synonyms:
None
SMILES:
O=S(=O)(N)CC1=NC(Cl)=NC=C1
Tpsa:
85.94
Logp:
-0.0815
H Acceptors:
4
H Donors:
1
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: C₅H₆N₆S
Molecular Weight: 182.21
Synonyms: None
SMILES: N1=NC(=CS1)CN2N=NC(N)=C2
Tpsa: 82.51
Logp: -0.2399
H Acceptors: 7
H Donors: 1
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:
C₅H₆N₆S
Molecular Weight:
182.21
Synonyms:
None
SMILES:
N1=NC(=CS1)CN2N=NC(N)=C2
Tpsa:
82.51
Logp:
-0.2399
H Acceptors:
7
H Donors:
1
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: C₉H₁₁NO₂
Molecular Weight: 165.19
Synonyms: None
SMILES: O=CC=1OC(=CC1)CN2CCC2
Tpsa: 33.45
Logp: 1.2978
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁NO₂
Molecular Weight:
165.19
Synonyms:
None
SMILES:
O=CC=1OC(=CC1)CN2CCC2
Tpsa:
33.45
Logp:
1.2978
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3